- InChI
- InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3
- InChI Key
- FXHGMKSSBGDXIY-UHFFFAOYSA-N
- Formula
- C7H14O
- SMILES
- CCCCCCC=O
- Molecular Weight1
- 114.19
- CAS
- 111-71-7
- Other Names
-
- 1-Heptaldehyde
- 1-Heptanal
- 1-hexanecarbaldehyde
- Enanthal
- Enanthic aldehyde
- Enanthole
- Heptan-1-al
- Heptanaldehyde
- NSC 2190
- Oenanthal
- Oenanthaldehyde
- Oenanthic aldehyde
- Oenanthol
- enanthaldehyde
- heptaldehyde
- heptyl aldehyde
- n-C6H13CHO
- n-Heptaldehyde
- n-Heptanal
- n-Heptylaldehyde
- ω : Acentric Factor.
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase heat capacity (J/mol×K).
- μ : Dipole Moment (debye).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Ptriple : Triple Point Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- ρc : Critical density (kg/m3).
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- Ip : Polar retention indices.
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- S°gas : Molar entropy at standard conditions (J/mol×K).
- S°liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
- γ : Surface Tension (N/m).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- λgas : Gas thermal conductivity (W/m×K).
- λliquid : Liquid thermal conductivity (W/m×K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (K).
- UQi : UNIQUAC Qi Parameter.
- URi : UNIQUAC Ri Parameter.
- Vc : Critical Volume (m3/kmol).
- Zc : Critical Compressibility.
- Zra : Rackett Parameter.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | [0.2590; 0.4885] |
|
|
| ω | 0.4258 | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value | |
| ω | 0.4885 | ChemSep v8.3 pure component data Compiled value | |
| ω | 0.2590 | KDB | |
| ΔcH°liquid | -4444.00 ± 4.00 | kJ/mol | NIST |
| μ | 2.58 | debye | ChemSep v8.3 pure component data Compiled value |
| ΔfG° | -86.53 | kJ/mol | ChemSep v8.3 pure component data Compiled value |
| ΔfH°gas | [-264.01; -264.00] | kJ/mol |
|
| ΔfH°gas | -264.01 | kJ/mol | ChemSep v8.3 pure component data Compiled value |
| ΔfH°gas | -264.00 ± 4.20 | kJ/mol | NIST |
| ΔfH°liquid | -312.00 ± 4.00 | kJ/mol | NIST |
| ΔfusH° | 16.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [47.30; 48.70] | kJ/mol |
|
| ΔvapH° | 48.70 | kJ/mol | NIST |
| ΔvapH° | 47.30 ± 0.10 | kJ/mol | NIST |
| ΔvapH° | 48.00 ± 1.00 | kJ/mol | NIST |
| ΔvapH° | 48.00 | kJ/mol | NIST |
| ΔvapH° | 48.00 ± 1.30 | kJ/mol | NIST |
| IE | 9.65 ± 0.02 | eV | NIST |
| log10WS | -1.70 | Aq. Solubility Prediction | |
| logPoct/wat | 2.156 | Crippen Calculated Property | |
| McVol | 111.060 | ml/mol | McGowan Calculated Property |
| Pc | [2800.00; 3232.27] | kPa |
|
| Pc | 3160.00 | kPa | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value |
| Pc | 3232.27 | kPa | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Pc | 2800.00 | kPa | ChemSep v8.3 pure component data Compiled value |
| Pc | 3030.00 | kPa | KDB |
| Pc | 3160.00 ± 25.00 | kPa | NIST |
| Ptriple | 1.45e-03 | kPa | ChemSep v8.3 pure component data Compiled value |
| ρc | 262.63 ± 4.57 | kg/m3 | NIST |
| Inp | [137.00; 937.00] |
|
|
| Inp | 851.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 913.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 933.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 874.10 | NIST | |
| Inp | 915.00 | NIST | |
| Inp | 911.00 | NIST | |
| Inp | 913.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 913.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 913.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 878.10 | NIST | |
| Inp | 899.70 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 912.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 917.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 913.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 857.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 858.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 912.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 937.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 909.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 880.65 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 909.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 921.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 913.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 916.00 | NIST | |
| Inp | 921.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 906.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 914.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 909.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 913.00 | NIST | |
| Inp | 917.00 | NIST | |
| Inp | 916.00 | NIST | |
| Inp | 909.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 911.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | Outlier 137.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | Outlier 137.00 | NIST | |
| Inp | 907.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 916.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 881.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 904.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 851.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 910.00 | NIST | |
| Inp | 912.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 888.00 | NIST | |
| Ip | [1148.00; 1222.00] |
|
|
| Ip | Outlier 1217.80 | NIST | |
| Ip | 1199.60 | NIST | |
| Ip | 1205.30 | NIST | |
| Ip | 1211.50 | NIST | |
| Ip | 1168.00 | NIST | |
| Ip | Outlier 1222.00 | NIST | |
| Ip | 1170.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1196.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1167.00 | NIST | |
| Ip | 1171.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | Outlier 1151.00 | NIST | |
| Ip | Outlier 1154.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1175.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1196.00 | NIST | |
| Ip | 1206.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1199.00 | NIST | |
| Ip | 1197.00 | NIST | |
| Ip | 1197.00 | NIST | |
| Ip | 1197.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1197.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1177.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1197.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | Outlier 1214.00 | NIST | |
| Ip | 1179.00 | NIST | |
| Ip | 1167.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1197.00 | NIST | |
| Ip | 1210.00 | NIST | |
| Ip | 1204.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1179.00 | NIST | |
| Ip | 1208.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1162.00 | NIST | |
| Ip | 1165.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1177.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1208.00 | NIST | |
| Ip | Outlier 1156.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1196.00 | NIST | |
| Ip | 1198.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1171.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1187.00 | NIST | |
| Ip | Outlier 1148.00 | NIST | |
| Ip | 1167.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | Outlier 1213.00 | NIST | |
| Ip | 1192.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1200.00 | NIST | |
| Ip | 1200.00 | NIST | |
| Ip | 1198.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | Outlier 1149.00 | NIST | |
| Ip | 1187.00 | NIST | |
| Ip | Outlier 1155.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1179.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1170.00 | NIST | |
| Ip | 1168.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1192.00 | NIST | |
| Ip | 1202.00 | NIST | |
| Ip | Outlier 1215.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1157.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1193.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1192.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1163.00 | NIST | |
| Ip | 1202.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1169.00 | NIST | |
| Ip | 1164.00 | NIST | |
| Ip | 1211.00 | NIST | |
| Ip | Outlier 1215.00 | NIST | |
| Ip | Outlier 1219.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1162.00 | NIST | |
| Ip | 1201.00 | NIST | |
| Ip | 1210.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1167.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1204.00 | NIST | |
| Ip | 1171.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1158.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1171.00 | NIST | |
| Ip | 1175.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1196.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | Outlier 1150.00 | NIST | |
| Ip | Outlier 1151.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1175.00 | NIST | |
| Ip | 1208.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1207.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1167.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1200.00 | NIST | |
| Ip | 1175.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1170.00 | NIST | |
| Ip | 1165.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1200.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | Outlier 1156.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1177.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1177.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1165.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1170.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1171.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1207.00 | NIST | |
| Ip | 1167.00 | NIST | |
| Ip | 1175.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1200.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | Outlier 1156.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1165.00 | NIST | |
| Ip | Outlier 1149.00 | NIST | |
| S°gas | 461.50 ± 4.20 | J/mol×K | NIST |
| S°liquid | [335.40; 348.50] | J/mol×K |
|
| S°liquid | 335.40 | J/mol×K | NIST |
| S°liquid | 348.50 | J/mol×K | NIST |
| Tboil | [424.65; 428.65] | K |
|
| Tboil | 425.95 | K | ChemSep v8.3 pure component data Compiled value |
| Tboil | 425.00 | K | KDB |
| Tboil | 426.00 | K | NIST |
| Tboil | 428.15 ± 3.00 | K | NIST |
| Tboil | 424.65 ± 3.00 | K | NIST |
| Tboil | 425.15 ± 2.00 | K | NIST |
| Tboil | 428.15 ± 3.00 | K | NIST |
| Tboil | 425.80 ± 0.20 | K | NIST |
| Tboil | 426.00 ± 2.00 | K | NIST |
| Tboil | 425.15 ± 2.00 | K | NIST |
| Tboil | 428.15 ± 3.00 | K | NIST |
| Tboil | 428.15 ± 3.00 | K | NIST |
| Tboil | 427.65 ± 2.00 | K | NIST |
| Tboil | 428.15 ± 3.00 | K | NIST |
| Tboil | 425.15 ± 1.00 | K | NIST |
| Tboil | 426.00 ± 0.30 | K | NIST |
| Tboil | 427.65 ± 2.00 | K | NIST |
| Tboil | 427.15 ± 3.00 | K | NIST |
| Tboil | 427.15 ± 3.00 | K | NIST |
| Tboil | 428.65 ± 3.00 | K | NIST |
| Tboil | 428.15 ± 3.00 | K | NIST |
| Tboil | 428.15 ± 2.00 | K | NIST |
| Tboil | 425.85 ± 2.00 | K | NIST |
| Tboil | 428.10 ± 1.00 | K | NIST |
| Tboil | 425.75 ± 3.00 | K | NIST |
| Tboil | 427.15 ± 3.00 | K | NIST |
| Tboil | 424.65 ± 3.00 | K | NIST |
| Tc | [161.80; 638.50] | K |
|
| Tc | 617.00 | K | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value |
| Tc | 614.00 | K | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Tc | 603.00 | K | ChemSep v8.3 pure component data Compiled value |
| Tc | 638.50 | K | KDB |
| Tc | 616.70 ± 0.60 | K | NIST |
| Tc | Outlier 161.80 ± 0.40 | K | NIST |
| Tfus | [216.80; 231.00] | K |
|
| Tfus | 230.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Tfus | 230.15 | K | ChemSep v8.3 pure component data Compiled value |
| Tfus | 230.00 | K | KDB |
| Tfus | 230.07 | K | Aq. Solubility Prediction |
| Tfus | 229.44 ± 0.50 | K | NIST |
| Tfus | 229.90 ± 1.00 | K | NIST |
| Tfus | Outlier 216.80 ± 2.00 | K | NIST |
| Tfus | 228.20 ± 2.00 | K | NIST |
| Tfus | 231.00 ± 5.00 | K | NIST |
| Ttriple | [229.20; 229.80] | K |
|
| Ttriple | 229.80 | K | ChemSep v8.3 pure component data Compiled value |
| Ttriple | 229.20 ± 0.02 | K | NIST |
| Ttriple | 229.80 ± 0.20 | K | NIST |
| Ttriple | 229.80 ± 0.20 | K | NIST |
| UQi | 4.50 | ChemSep v8.3 pure component data Compiled value | |
| URi | 5.27 | ChemSep v8.3 pure component data Compiled value | |
| Vc | [0.421; 0.445] | m3/kmol |
|
| Vc | 0.434 | m3/kmol | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value |
| Vc | 0.434 | m3/kmol | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Vc | 0.421 | m3/kmol | ChemSep v8.3 pure component data Compiled value |
| Vc | 0.445 | m3/kmol | KDB |
| Zc | [0.2536980; 0.2670000] |
|
|
| Zc | 0.2670000 | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value | |
| Zc | 0.2670000 | ChemSep v8.3 pure component data Compiled value | |
| Zc | 0.2536980 | KDB | |
| Zra | 0.25 | ChemSep v8.3 pure component data Compiled value |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | [204.60; 250.33] | J/mol×K | [298.00; 298.15] |
|
| Cp,liquid | 204.60 | J/mol×K | 298.00 | NIST |
| Cp,liquid | 230.78 | J/mol×K | 298.15 | NIST |
| Cp,liquid | 250.33 | J/mol×K | 298.15 | NIST |
| ΔfusH | [22.89; 23.59] | kJ/mol | [229.30; 229.80] |
|
| ΔfusH | 22.89 | kJ/mol | 229.30 | NIST |
| ΔfusH | 22.89 | kJ/mol | 229.30 | NIST |
| ΔfusH | 23.59 | kJ/mol | 229.80 | NIST |
| ΔfusH | 23.59 | kJ/mol | 229.80 | NIST |
| ΔvapH | [47.75; 62.00] | kJ/mol | [356.50; 425.00] |
|
| ΔvapH | 62.00 | kJ/mol | 356.50 | NIST |
| ΔvapH | 47.75 | kJ/mol | 425.00 | KDB |
| ρl | 816.83 | kg/m3 | 298.15 | Liquid-liquid equilibria and density data for pseudoternary systems of refined soybean oil + (hexanal, or heptanal, or butyric acid, or valeric acid, or caproic acid, or caprylic acid) + dimethyl sulfoxide at 298.15 K |
| ΔfusS | [102.63; 102.63] | J/mol×K | [229.80; 229.80] |
|
| ΔfusS | 102.63 | J/mol×K | 229.80 | NIST |
| ΔfusS | 102.63 | J/mol×K | 229.80 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 332.80 | K | 4.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [141.79; 429.82] | J/mol×K | [200.00; 1500.00] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 1.31660e+02 | |||
| Coefficient B | -8.58870e+02 | |||
| Coefficient C | 6.68824e+00 | |||
| Coefficient D | -4.12130e-04 | |||
| Coefficient E | 8.89550e-08 | |||
| Temperature range, min. | 200.00 | |||
| Temperature range, max. | 1500.00 | |||
| Cp,gas | 141.79 | J/mol×K | 200.00 | Calculated Property |
| Cp,gas | 189.83 | J/mol×K | 344.44 | Calculated Property |
| Cp,gas | 247.39 | J/mol×K | 488.89 | Calculated Property |
| Cp,gas | 296.80 | J/mol×K | 633.33 | Calculated Property |
| Cp,gas | 335.48 | J/mol×K | 777.78 | Calculated Property |
| Cp,gas | 365.01 | J/mol×K | 922.22 | Calculated Property |
| Cp,gas | 387.53 | J/mol×K | 1066.67 | Calculated Property |
| Cp,gas | 404.92 | J/mol×K | 1211.11 | Calculated Property |
| Cp,gas | 418.65 | J/mol×K | 1355.56 | Calculated Property |
| Cp,gas | 429.82 | J/mol×K | 1500.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | [232.00; 307.76] | J/mol×K | [229.80; 462.75] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is Cp,liquid in J/mol×K, T in K | |||
| Coefficient A | 2.00220e+02 | |||
| Coefficient B | 1.28230e+02 | |||
| Coefficient C | 5.66245e-01 | |||
| Coefficient D | 1.20080e-02 | |||
| Coefficient E | -8.04230e-06 | |||
| Temperature range, min. | 229.80 | |||
| Temperature range, max. | 462.75 | |||
| Cp,liquid | 232.00 | J/mol×K | 229.80 | Calculated Property |
| Cp,liquid | 237.27 | J/mol×K | 255.68 | Calculated Property |
| Cp,liquid | 243.39 | J/mol×K | 281.57 | Calculated Property |
| Cp,liquid | 250.37 | J/mol×K | 307.45 | Calculated Property |
| Cp,liquid | 258.20 | J/mol×K | 333.33 | Calculated Property |
| Cp,liquid | 266.84 | J/mol×K | 359.22 | Calculated Property |
| Cp,liquid | 276.23 | J/mol×K | 385.10 | Calculated Property |
| Cp,liquid | 286.27 | J/mol×K | 410.98 | Calculated Property |
| Cp,liquid | 296.84 | J/mol×K | 436.87 | Calculated Property |
| Cp,liquid | 307.76 | J/mol×K | 462.75 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0025715; 0.0002398] | Pa×s | [229.80; 473.00] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | 8.40770e+00 | |||
| Coefficient B | 4.75870e+02 | |||
| Coefficient C | -3.07580e+00 | |||
| Coefficient D | 5.34040e-06 | |||
| Coefficient E | 2.00000e+00 | |||
| Temperature range, min. | 229.80 | |||
| Temperature range, max. | 473.00 | |||
| η | 0.0025715 | Pa×s | 229.80 | Calculated Property |
| η | 0.0015760 | Pa×s | 256.82 | Calculated Property |
| η | 0.0010500 | Pa×s | 283.84 | Calculated Property |
| η | 0.0007477 | Pa×s | 310.87 | Calculated Property |
| η | 0.0005621 | Pa×s | 337.89 | Calculated Property |
| η | 0.0004424 | Pa×s | 364.91 | Calculated Property |
| η | 0.0003621 | Pa×s | 391.93 | Calculated Property |
| η | 0.0003066 | Pa×s | 418.96 | Calculated Property |
| η | 0.0002675 | Pa×s | 445.98 | Calculated Property |
| η | 0.0002398 | Pa×s | 473.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | [51.38; 12.85] | kJ/mol | [229.80; 596.43] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A·(1 − Tr)^(B + C·Tr + D·Tr² + E·Tr³), Tr = T/Tc Y is ΔvapH in kJ/mol, T in K | |||
| Coefficient A | 6.24412e+01 | |||
| Coefficient B | 2.24744e-01 | |||
| Coefficient C | 9.49788e-01 | |||
| Coefficient D | -1.50032e+00 | |||
| Coefficient E | 6.75167e-01 | |||
| Critical temperature, Tc (K) | 6.03000e+02 | |||
| Temperature range, min. | 229.80 | |||
| Temperature range, max. | 596.43 | |||
| ΔvapH | 51.38 | kJ/mol | 229.80 | Calculated Property |
| ΔvapH | 48.92 | kJ/mol | 270.54 | Calculated Property |
| ΔvapH | 46.43 | kJ/mol | 311.27 | Calculated Property |
| ΔvapH | 43.89 | kJ/mol | 352.01 | Calculated Property |
| ΔvapH | 41.25 | kJ/mol | 392.75 | Calculated Property |
| ΔvapH | 38.41 | kJ/mol | 433.48 | Calculated Property |
| ΔvapH | 35.15 | kJ/mol | 474.22 | Calculated Property |
| ΔvapH | 31.10 | kJ/mol | 514.96 | Calculated Property |
| ΔvapH | 25.34 | kJ/mol | 555.69 | Calculated Property |
| ΔvapH | 12.85 | kJ/mol | 596.43 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [323.26; 451.69] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.56266e+01 | |||
| Coefficient B | -4.04483e+03 | |||
| Coefficient C | -5.95640e+01 | |||
| Temperature range, min. | 323.26 | |||
| Temperature range, max. | 451.69 | |||
| Pvap | 1.33 | kPa | 323.26 | Calculated Property |
| Pvap | 2.93 | kPa | 337.53 | Calculated Property |
| Pvap | 5.96 | kPa | 351.80 | Calculated Property |
| Pvap | 11.36 | kPa | 366.07 | Calculated Property |
| Pvap | 20.43 | kPa | 380.34 | Calculated Property |
| Pvap | 34.96 | kPa | 394.61 | Calculated Property |
| Pvap | 57.24 | kPa | 408.88 | Calculated Property |
| Pvap | 90.18 | kPa | 423.15 | Calculated Property |
| Pvap | 137.26 | kPa | 437.42 | Calculated Property |
| Pvap | 202.65 | kPa | 451.69 | Calculated Property |
| Pvap | [9.94e-04; 3167.13] | kPa | [229.80; 617.00] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.01452e+02 | |||
| Coefficient B | -9.17960e+03 | |||
| Coefficient C | -1.26550e+01 | |||
| Coefficient D | 7.33630e-06 | |||
| Coefficient E | 2.00000e+00 | |||
| Temperature range, min. | 229.80 | |||
| Temperature range, max. | 617.00 | |||
| Pvap | 9.94e-04 | kPa | 229.80 | Calculated Property |
| Pvap | 0.07 | kPa | 272.82 | Calculated Property |
| Pvap | 1.33 | kPa | 315.84 | Calculated Property |
| Pvap | 10.69 | kPa | 358.87 | Calculated Property |
| Pvap | 50.12 | kPa | 401.89 | Calculated Property |
| Pvap | 164.58 | kPa | 444.91 | Calculated Property |
| Pvap | 423.66 | kPa | 487.93 | Calculated Property |
| Pvap | 921.10 | kPa | 530.96 | Calculated Property |
| Pvap | 1779.71 | kPa | 573.98 | Calculated Property |
| Pvap | 3167.13 | kPa | 617.00 | Calculated Property |
| Pvap | [7.26e-04; 2531.38] | kPa | [230.15; 603.00] |
KDB Vapor Pressure Data
|
| Equation | ln(Y) = A + B/T + C·ln(T) + D·T² + E/T² Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.14364e+02 | |||
| Coefficient B | -9.97308e+03 | |||
| Coefficient C | -1.44580e+01 | |||
| Coefficient D | 7.06940e-06 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 230.15 | |||
| Temperature range, max. | 603.00 | |||
| Pvap | 7.26e-04 | kPa | 230.15 | Calculated Property |
| Pvap | 0.06 | kPa | 271.58 | Calculated Property |
| Pvap | 1.12 | kPa | 313.01 | Calculated Property |
| Pvap | 9.38 | kPa | 354.43 | Calculated Property |
| Pvap | 44.89 | kPa | 395.86 | Calculated Property |
| Pvap | 147.83 | kPa | 437.29 | Calculated Property |
| Pvap | 375.89 | kPa | 478.72 | Calculated Property |
| Pvap | 797.22 | kPa | 520.14 | Calculated Property |
| Pvap | 1486.86 | kPa | 561.57 | Calculated Property |
| Pvap | 2531.38 | kPa | 603.00 | Calculated Property |
| Pvap | [0.11; 106.31] | kPa | [285.00; 428.00] |
NIST
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.05937e+01 | |||
| Coefficient B | -1.58062e+03 | |||
| Coefficient C | -1.61333e+02 | |||
| Reference | Stull, 1947 | |||
| Comment | Coefficents calculated by NIST from author's data. | |||
| Temperature range, min. | 285.00 | |||
| Temperature range, max. | 428.00 | |||
| Pvap | 0.11 | kPa | 285.00 | Calculated Property |
| Pvap | 0.48 | kPa | 300.89 | Calculated Property |
| Pvap | 1.53 | kPa | 316.78 | Calculated Property |
| Pvap | 3.93 | kPa | 332.67 | Calculated Property |
| Pvap | 8.60 | kPa | 348.56 | Calculated Property |
| Pvap | 16.64 | kPa | 364.44 | Calculated Property |
| Pvap | 29.26 | kPa | 380.33 | Calculated Property |
| Pvap | 47.68 | kPa | 396.22 | Calculated Property |
| Pvap | 73.03 | kPa | 412.11 | Calculated Property |
| Pvap | 106.31 | kPa | 428.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ρl | [867.43; 269.17] | kg/m3 | [229.80; 616.80] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A / B^(1 + (1 − T/C)^D) Y is ρl in kg/m3, T in K | |||
| Coefficient A | 6.12560e+01 | |||
| Coefficient B | 2.44520e-01 | |||
| Coefficient C | 6.16810e+02 | |||
| Coefficient D | 2.69810e-01 | |||
| Temperature range, min. | 229.80 | |||
| Temperature range, max. | 616.80 | |||
| ρl | 867.43 | kg/m3 | 229.80 | Calculated Property |
| ρl | 834.38 | kg/m3 | 272.80 | Calculated Property |
| ρl | 799.60 | kg/m3 | 315.80 | Calculated Property |
| ρl | 762.67 | kg/m3 | 358.80 | Calculated Property |
| ρl | 722.99 | kg/m3 | 401.80 | Calculated Property |
| ρl | 679.57 | kg/m3 | 444.80 | Calculated Property |
| ρl | 630.77 | kg/m3 | 487.80 | Calculated Property |
| ρl | 573.21 | kg/m3 | 530.80 | Calculated Property |
| ρl | 497.75 | kg/m3 | 573.80 | Calculated Property |
| ρl | 269.17 | kg/m3 | 616.80 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| γ | [0.03; 0.01] | N/m | [230.15; 426.15] |
Jasper (1972), surface tension of pure liquid compounds Compiled value
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is γ in N/m, T in K | |||
| Coefficient A | 5.37698e-02 | |||
| Coefficient B | -9.20000e-05 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 230.15 | |||
| Temperature range, max. | 426.15 | |||
| γ | 0.03 | N/m | 230.15 | Calculated Property |
| γ | 0.03 | N/m | 251.93 | Calculated Property |
| γ | 0.03 | N/m | 273.71 | Calculated Property |
| γ | 0.03 | N/m | 295.48 | Calculated Property |
| γ | 0.02 | N/m | 317.26 | Calculated Property |
| γ | 0.02 | N/m | 339.04 | Calculated Property |
| γ | 0.02 | N/m | 360.82 | Calculated Property |
| γ | 0.02 | N/m | 382.59 | Calculated Property |
| γ | 0.02 | N/m | 404.37 | Calculated Property |
| γ | 0.01 | N/m | 426.15 | Calculated Property |
| γ | [0.03; 2.02e-05] | N/m | [229.80; 594.23] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is γ in N/m, T in K | |||
| Coefficient A | -7.38510e-02 | |||
| Coefficient B | -3.22800e+01 | |||
| Coefficient C | -1.70800e+00 | |||
| Coefficient D | -1.83010e-03 | |||
| Coefficient E | 6.92110e-07 | |||
| Comment | Range stopped where the equation turns negative; ChemSep gives it to 596.43 K. | |||
| Temperature range, min. | 229.80 | |||
| Temperature range, max. | 594.23 | |||
| γ | 0.03 | N/m | 229.80 | Calculated Property |
| γ | 0.03 | N/m | 270.29 | Calculated Property |
| γ | 0.03 | N/m | 310.78 | Calculated Property |
| γ | 0.02 | N/m | 351.28 | Calculated Property |
| γ | 0.02 | N/m | 391.77 | Calculated Property |
| γ | 0.01 | N/m | 432.26 | Calculated Property |
| γ | 0.01 | N/m | 472.75 | Calculated Property |
| γ | 0.01 | N/m | 513.25 | Calculated Property |
| γ | 0.00 | N/m | 553.74 | Calculated Property |
| γ | 2.02e-05 | N/m | 594.23 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| λgas | [0.01; 0.11] | W/m×K | [229.80; 1000.00] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A·T^B / (1 + C/T + D/T²) Y is λgas in W/m×K, T in K | |||
| Coefficient A | 1.56920e+03 | |||
| Coefficient B | 1.01020e+00 | |||
| Coefficient C | 1.48740e+10 | |||
| Coefficient D | 2.75360e+11 | |||
| Temperature range, min. | 229.80 | |||
| Temperature range, max. | 1000.00 | |||
| λgas | 0.01 | W/m×K | 229.80 | Calculated Property |
| λgas | 0.01 | W/m×K | 315.38 | Calculated Property |
| λgas | 0.02 | W/m×K | 400.96 | Calculated Property |
| λgas | 0.03 | W/m×K | 486.53 | Calculated Property |
| λgas | 0.04 | W/m×K | 572.11 | Calculated Property |
| λgas | 0.05 | W/m×K | 657.69 | Calculated Property |
| λgas | 0.06 | W/m×K | 743.27 | Calculated Property |
| λgas | 0.08 | W/m×K | 828.84 | Calculated Property |
| λgas | 0.09 | W/m×K | 914.42 | Calculated Property |
| λgas | 0.11 | W/m×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| λliquid | [0.16; 0.08] | W/m×K | [229.80; 553.15] |
ChemSep v8.3 pure component data Compiled value
|
| Equation | Y = A + exp(B/T + C + D·T + E·T²) Y is λliquid in W/m×K, T in K | |||
| Coefficient A | 2.75400e-02 | |||
| Coefficient B | -5.50740e+01 | |||
| Coefficient C | -1.24300e+00 | |||
| Coefficient D | -2.20840e-03 | |||
| Coefficient E | -1.06370e-06 | |||
| Temperature range, min. | 229.80 | |||
| Temperature range, max. | 553.15 | |||
| λliquid | 0.16 | W/m×K | 229.80 | Calculated Property |
| λliquid | 0.15 | W/m×K | 265.73 | Calculated Property |
| λliquid | 0.14 | W/m×K | 301.66 | Calculated Property |
| λliquid | 0.13 | W/m×K | 337.58 | Calculated Property |
| λliquid | 0.12 | W/m×K | 373.51 | Calculated Property |
| λliquid | 0.11 | W/m×K | 409.44 | Calculated Property |
| λliquid | 0.10 | W/m×K | 445.37 | Calculated Property |
| λliquid | 0.10 | W/m×K | 481.29 | Calculated Property |
| λliquid | 0.09 | W/m×K | 517.22 | Calculated Property |
| λliquid | 0.08 | W/m×K | 553.15 | Calculated Property |
Similar Compounds
Find more compounds similar to Heptanal.
Sources
- KDB Vapor Pressure Data
- Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
- IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 ChEDL chemicals 1.5.2, from Kudchadker, A. P.; Ambrose, D.; Tsonopoulos, C. Vapor-Liquid Critical Properties of Elements and Compounds. 7. Oxygen Compounds Other Than Alkanols and Cycloalkanols. J. Chem. Eng. Data 2001, 46, 457-479.
- Jasper (1972), surface tension of pure liquid compounds ChEDL chemicals 1.5.2, from Jasper, J. J. The Surface Tension of Pure Liquid Compounds. J. Phys. Chem. Ref. Data 1972, 1, 841-1010 (as transcribed in Lange's Handbook).
- PSRK revision IV (2005), critical constants and acentric factors of 1000 components ChEDL chemicals 1.5.2, from Horstmann, S.; Jabłoniec, A.; Krafczyk, J.; Fischer, K.; Gmehling, J. PSRK Group Contribution Equation of State: Comprehensive Revision and Extension IV, Including Critical Constants and α-Function Parameters for 1000 Components. Fluid Phase Equilib. 2005, 227, 157-164.
- ChemSep v8.3 pure component data Converted from ChemSep v8.3 pure component data, H. Kooijman and R. Taylor (2021, 2022), Artistic License 2.0; see how the values differ.
- Crippen Method
- Quantitative NMR spectroscopy of binary liquid mixtures (aldehyde + alcohol). Part II: (Propanal or butanal or heptanal) + (methanol or ethanol or 1-propanol)
- Liquid-liquid equilibria and density data for pseudoternary systems of refined soybean oil + (hexanal, or heptanal, or butyric acid, or valeric acid, or caproic acid, or caprylic acid) + dimethyl sulfoxide at 298.15 K
- Thermodynamic Properties of Mixtures Containing Ionic Liquids. 8. Activity Coefficients at Infinite Dilution of Hydrocarbons, Alcohols, Esters, and Aldehydes in 1-Hexyl-3-methylimidazolium Bis(trifluoromethylsulfonyl) Imide Using Gas-Liquid Chromatography
- Thermodynamic Properties of Mixtures Containing Ionic Liquids. 9. Activity Coefficients at Infinite Dilution of Hydrocarbons, Alcohols, Esters, and Aldehydes in Trimethyl-butylammonium Bis(trifluoromethylsulfonyl) Imide Using Gas-Liquid Chromatography and Static Method
- Experimental Study of Thermodynamic Properties of Mixtures Containing Ionic Liquid 1-Ethyl-3-methylimidazolium Ethyl Sulfate Using Gas-Liquid Chromatography and Transpiration Method
- Joback Method
- KDB
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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