- InChI
- InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3
- InChI Key
- CATSNJVOTSVZJV-UHFFFAOYSA-N
- Formula
- C7H14O
- SMILES
- CCCCCC(C)=O
- Molecular Weight1
- 114.19
- CAS
- 110-43-0
- Other Names
-
- 2-Heptanal
- 2-Ketoheptane
- Amyl methyl ketone
- Amyl-methyl-cetone
- Heptan-2-one
- Heptanone-2
- Ketone C-7
- Ketone, methyl pentyl
- Methyl n-amyl ketone
- Methyl n-pentyl ketone
- Methyl-amyl-cetone
- NSC 7313
- Pentyl methyl ketone
- UN 1110
- butylacetone
- methyl amyl ketone
- methyl pentyl ketone
- n-Amyl methyl ketone
- n-C5H11COCH3
- n-Pentyl methyl ketone
- ω : Acentric Factor.
- Tig : Autoignition Temperature (K).
- 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).
- εr : Dielectric Constant (Relative permittivity).
- LFL : Lower Flammability Limit (% in Air).
- UFL : Upper Flammability Limit (% in Air).
- Tflash,cc : Flash Point (Closed Cup Method) (K).
- Tflash,oc : Flash Point (Open Cup Method) (K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : 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).
- NFPA Fire : NFPA Fire Rating.
- NFPA Health : NFPA Health Rating.
- NFPA Safety : NFPA Safety Rating.
- Pc : Critical Pressure (kPa).
- Ptriple : Triple Point Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- n0 : Refractive Index.
- ρc : Critical density (kg/m3).
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- Ip : Polar retention indices.
- csound,fluid : Speed of sound in fluid (m/s).
- 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 | [0.4190; 0.4830] |
|
|
| ω | 0.4250 | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value | |
| ω | 0.4190 | ChemSep v8.3 pure component data Compiled value | |
| ω | 0.4830 | KDB | |
| Tig | 666.15 | K | NCMS SOLV-DB |
| μ | 2.61 | debye | ChemSep v8.3 pure component data Compiled value |
| εr | 11.98 | NCMS SOLV-DB | |
| LFL | 1.11 | % in Air | KDB |
| UFL | 7.90 | % in Air | KDB |
| Tflash,cc | [312.15; 320.37] | K |
|
| Tflash,cc | 320.37 | K | KDB |
| Tflash,cc | 312.15 | K | NCMS SOLV-DB |
| Tflash,oc | 312.04 | K | KDB |
| ΔfG° | -121.80 | kJ/mol | ChemSep v8.3 pure component data Compiled value |
| ΔfH°gas | -300.45 | kJ/mol | ChemSep v8.3 pure component data Compiled value |
| ΔfusH° | 19.09 | kJ/mol | Measurements, Correlations, and Mod. UNIFAC (Do) Prediction of (Solid-Liquid) Phase Equilibria Diagrams in Binary Systems (Aliphatic Ketone + an Alcohol) |
| ΔvapH° | [46.10; 48.50] | kJ/mol |
|
| ΔvapH° | 47.24 | kJ/mol | NCMS SOLV-DB |
| ΔvapH° | 46.10 | kJ/mol | NIST |
| ΔvapH° | 48.50 | kJ/mol | NIST |
| ΔvapH° | 47.40 ± 0.30 | kJ/mol | NIST |
| ΔvapH° | 47.24 ± 0.05 | kJ/mol | NIST |
| ΔvapH° | 47.20 ± 0.10 | kJ/mol | NIST |
| ΔvapH° | 48.00 | kJ/mol | NIST |
| IE | [9.18; 9.79] | eV |
|
| IE | 9.27 ± 0.06 | eV | NIST |
| IE | 9.18 ± 0.02 | eV | NIST |
| IE | 9.30 ± 0.01 | eV | NIST |
| IE | Outlier 9.79 | eV | NIST |
| IE | 9.33 ± 0.03 | eV | NIST |
| IE | 9.36 | eV | NIST |
| log10WS | [-1.45; -1.42] |
|
|
| log10WS | -1.42 | Aq. Solubility Prediction | |
| log10WS | -1.45 | Estimated Solubility | |
| logPoct/wat | 1.980 | NCMS SOLV-DB | |
| McVol | 111.060 | ml/mol | McGowan Calculated Property |
| NFPA Fire | [%!d(float64=2); %!d(float64=2)] |
|
|
| NFPA Fire | 2 | KDB | |
| NFPA Fire | 2 | NCMS SOLV-DB | |
| NFPA Health | [%!d(float64=1); %!d(float64=1)] |
|
|
| NFPA Health | 1 | KDB | |
| NFPA Health | 1 | NCMS SOLV-DB | |
| NFPA Safety | 0 | NCMS SOLV-DB | |
| Pc | [2920.00; 2989.09] | kPa |
|
| Pc | 2970.00 | kPa | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value |
| Pc | 2989.09 | kPa | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Pc | 2920.00 | kPa | ChemSep v8.3 pure component data Compiled value |
| Ptriple | 3.54e-03 | kPa | ChemSep v8.3 pure component data Compiled value |
| ρc | 261.48 ± 3.43 | kg/m3 | NIST |
| Inp | [838.00; 911.00] |
|
|
| Inp | 868.70 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 870.20 | NIST | |
| Inp | 876.50 | NIST | |
| Inp | 892.30 | NIST | |
| Inp | 893.30 | NIST | |
| Inp | 894.70 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 855.00 | NIST | |
| Inp | Outlier 846.00 | NIST | |
| Inp | Outlier 838.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | Outlier 845.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | Outlier 846.00 | NIST | |
| Inp | 853.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | Outlier 849.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 877.10 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | Outlier 846.90 | NIST | |
| Inp | 887.30 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 869.90 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 887.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 879.00 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 876.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | Outlier 844.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | Outlier 852.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | Outlier 844.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 875.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 885.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 893.70 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 896.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 871.95 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 877.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 860.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 867.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | Outlier 911.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 898.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 854.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 887.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 863.00 | NIST | |
| Inp | 908.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 878.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 882.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 864.00 | NIST | |
| Inp | 897.00 | NIST | |
| Inp | 886.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 893.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | 868.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 892.00 | NIST | |
| Inp | Outlier 846.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 894.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 899.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 865.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 859.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 870.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 872.00 | NIST | |
| Inp | 880.00 | NIST | |
| Inp | 901.00 | NIST | |
| Inp | 871.00 | NIST | |
| Inp | 884.00 | NIST | |
| Inp | 889.00 | NIST | |
| Inp | 890.00 | NIST | |
| Inp | 905.00 | NIST | |
| Inp | 895.00 | NIST | |
| Inp | 877.10 | NIST | |
| Inp | 900.00 | NIST | |
| Inp | 869.00 | NIST | |
| Inp | 891.00 | NIST | |
| Inp | 874.00 | NIST | |
| Inp | 866.00 | NIST | |
| Inp | 873.00 | NIST | |
| Inp | 856.00 | NIST | |
| Inp | 868.70 | NIST | |
| Inp | 870.20 | NIST | |
| Inp | Outlier 838.00 | NIST | |
| Inp | 853.00 | NIST | |
| Ip | [1145.00; 1216.00] |
|
|
| Ip | Outlier 1213.80 | NIST | |
| Ip | 1195.80 | NIST | |
| Ip | 1201.90 | NIST | |
| Ip | Outlier 1207.60 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1175.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1175.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1193.00 | NIST | |
| Ip | 1193.00 | NIST | |
| Ip | Outlier 1213.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1200.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1186.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | Outlier 1208.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1161.00 | NIST | |
| Ip | 1162.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1179.00 | NIST | |
| Ip | Outlier 1145.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1171.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1187.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1187.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1201.00 | NIST | |
| Ip | 1198.00 | NIST | |
| Ip | 1193.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1207.00 | NIST | |
| Ip | 1199.00 | NIST | |
| Ip | 1198.00 | NIST | |
| Ip | 1206.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1179.00 | NIST | |
| Ip | Outlier 1154.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1158.00 | NIST | |
| Ip | 1171.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1192.00 | NIST | |
| Ip | 1192.00 | NIST | |
| Ip | 1175.00 | NIST | |
| Ip | 1165.00 | NIST | |
| Ip | 1164.00 | NIST | |
| Ip | 1200.00 | NIST | |
| Ip | 1205.00 | NIST | |
| Ip | 1205.00 | NIST | |
| Ip | 1206.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1200.00 | NIST | |
| Ip | 1179.00 | NIST | |
| Ip | 1184.00 | NIST | |
| Ip | 1181.00 | NIST | |
| Ip | 1177.00 | NIST | |
| Ip | 1198.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1169.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1199.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1171.00 | NIST | |
| Ip | Outlier 1151.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1158.00 | NIST | |
| Ip | 1168.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1158.00 | NIST | |
| Ip | 1158.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1187.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1177.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1170.00 | NIST | |
| Ip | Outlier 1216.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1190.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1189.00 | NIST | |
| Ip | 1191.00 | NIST | |
| Ip | 1178.00 | NIST | |
| Ip | 1177.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1188.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1170.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1192.00 | NIST | |
| Ip | 1192.00 | NIST | |
| Ip | 1196.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Ip | 1182.00 | NIST | |
| Ip | 1160.00 | NIST | |
| Ip | 1158.00 | NIST | |
| Ip | 1192.00 | NIST | |
| Ip | 1176.00 | NIST | |
| Ip | 1174.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1177.00 | NIST | |
| Ip | 1180.00 | NIST | |
| Ip | 1194.00 | NIST | |
| Ip | 1183.00 | NIST | |
| Ip | 1173.00 | NIST | |
| Ip | 1185.00 | NIST | |
| Ip | 1179.00 | NIST | |
| Ip | 1195.00 | NIST | |
| Ip | 1172.00 | NIST | |
| Tboil | [417.15; 425.15] | K |
|
| Tboil | 424.05 | K | ChemSep v8.3 pure component data Compiled value |
| Tboil | 424.20 | K | KDB |
| Tboil | 424.25 | K | NCMS SOLV-DB |
| Tboil | 422.70 | K | NIST |
| Tboil | 424.60 | K | NIST |
| Tboil | 424.65 | K | NIST |
| Tboil | 423.65 ± 1.00 | K | NIST |
| Tboil | 424.00 ± 0.40 | K | NIST |
| Tboil | 424.00 ± 0.40 | K | NIST |
| Tboil | 424.15 ± 1.00 | K | NIST |
| Tboil | 423.65 ± 0.50 | K | NIST |
| Tboil | 424.15 ± 0.50 | K | NIST |
| Tboil | 424.18 ± 0.10 | K | NIST |
| Tboil | Outlier 418.15 ± 10.00 | K | NIST |
| Tboil | 425.15 ± 2.00 | K | NIST |
| Tboil | 421.95 ± 1.00 | K | NIST |
| Tboil | 422.90 ± 1.00 | K | NIST |
| Tboil | 423.65 ± 3.00 | K | NIST |
| Tboil | 423.40 ± 0.50 | K | NIST |
| Tboil | 423.15 ± 1.00 | K | NIST |
| Tboil | 424.40 ± 0.50 | K | NIST |
| Tboil | 423.40 ± 0.20 | K | NIST |
| Tboil | 421.65 ± 2.00 | K | NIST |
| Tboil | 420.65 ± 4.00 | K | NIST |
| Tboil | 424.25 ± 0.50 | K | NIST |
| Tboil | 423.65 ± 1.00 | K | NIST |
| Tboil | 422.00 ± 10.00 | K | NIST |
| Tboil | 423.56 ± 0.20 | K | NIST |
| Tboil | 424.60 ± 0.20 | K | NIST |
| Tboil | 424.65 ± 1.00 | K | NIST |
| Tboil | 424.15 ± 1.00 | K | NIST |
| Tboil | 422.15 ± 2.00 | K | NIST |
| Tboil | Outlier 417.65 ± 10.00 | K | NIST |
| Tboil | 423.15 ± 1.00 | K | NIST |
| Tboil | 424.65 ± 1.00 | K | NIST |
| Tboil | 424.15 ± 1.00 | K | NIST |
| Tboil | Outlier 417.15 ± 10.00 | K | NIST |
| Tc | [611.40; 611.55] | K |
|
| Tc | 611.40 | K | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value |
| Tc | 611.50 | K | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Tc | 611.55 | K | ChemSep v8.3 pure component data Compiled value |
| Tc | 611.50 | K | KDB |
| Tc | 611.40 ± 0.30 | K | NIST |
| Tc | 611.50 ± 0.40 | K | NIST |
| Tfus | [238.00; 238.15] | K |
|
| Tfus | 238.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Tfus | 238.15 | K | ChemSep v8.3 pure component data Compiled value |
| Tfus | 238.00 | K | KDB |
| Tfus | 238.15 | K | NCMS SOLV-DB |
| Tfus | 238.15 | K | NIST |
| Ttriple | 238.15 | K | ChemSep v8.3 pure component data Compiled value |
| 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; 0.436] | m3/kmol |
|
| Vc | 0.436 | 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 |
| Zc | [0.2510000; 0.2560000] |
|
|
| Zc | 0.2560000 | IUPAC Vapor-Liquid Critical Properties of Elements and Compounds, part 7 Compiled value | |
| Zc | 0.2510000 | ChemSep v8.3 pure component data Compiled value | |
| Zra | 0.25 | ChemSep v8.3 pure component data Compiled value |
Temperature Dependent Properties
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 384.20 | K | 2.80 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [124.84; 385.07] | J/mol×K | [150.00; 1200.00] |
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 | 1.19760e+02 | |||
| Coefficient B | -7.02710e+02 | |||
| Coefficient C | 6.32124e+00 | |||
| Coefficient D | -7.42620e-05 | |||
| Coefficient E | -4.55950e-08 | |||
| Temperature range, min. | 150.00 | |||
| Temperature range, max. | 1200.00 | |||
| Cp,gas | 124.84 | J/mol×K | 150.00 | Calculated Property |
| Cp,gas | 158.74 | J/mol×K | 266.67 | Calculated Property |
| Cp,gas | 205.64 | J/mol×K | 383.33 | Calculated Property |
| Cp,gas | 249.73 | J/mol×K | 500.00 | Calculated Property |
| Cp,gas | 286.86 | J/mol×K | 616.67 | Calculated Property |
| Cp,gas | 316.92 | J/mol×K | 733.33 | Calculated Property |
| Cp,gas | 340.83 | J/mol×K | 850.00 | Calculated Property |
| Cp,gas | 359.59 | J/mol×K | 966.67 | Calculated Property |
| Cp,gas | 374.09 | J/mol×K | 1083.33 | Calculated Property |
| Cp,gas | 385.07 | J/mol×K | 1200.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | [230.60; 321.54] | J/mol×K | [238.15; 490.00] |
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 | 1.68580e+02 | |||
| Coefficient B | 7.59370e+02 | |||
| Coefficient C | -3.54736e+00 | |||
| Coefficient D | 2.30880e-02 | |||
| Coefficient E | -1.78480e-05 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 490.00 | |||
| Cp,liquid | 230.60 | J/mol×K | 238.15 | Calculated Property |
| Cp,liquid | 234.36 | J/mol×K | 266.13 | Calculated Property |
| Cp,liquid | 240.90 | J/mol×K | 294.12 | Calculated Property |
| Cp,liquid | 249.64 | J/mol×K | 322.10 | Calculated Property |
| Cp,liquid | 260.15 | J/mol×K | 350.08 | Calculated Property |
| Cp,liquid | 272.01 | J/mol×K | 378.07 | Calculated Property |
| Cp,liquid | 284.74 | J/mol×K | 406.05 | Calculated Property |
| Cp,liquid | 297.72 | J/mol×K | 434.03 | Calculated Property |
| Cp,liquid | 310.24 | J/mol×K | 462.02 | Calculated Property |
| Cp,liquid | 321.54 | J/mol×K | 490.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0016469; 0.0001527] | Pa×s | [250.00; 511.00] |
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 | -9.57090e+00 | |||
| Coefficient B | 1.18660e+03 | |||
| Coefficient C | -3.01870e-01 | |||
| Coefficient D | 1.31850e-06 | |||
| Coefficient E | 2.00000e+00 | |||
| Temperature range, min. | 250.00 | |||
| Temperature range, max. | 511.00 | |||
| η | 0.0016469 | Pa×s | 250.00 | Calculated Property |
| η | 0.0009927 | Pa×s | 279.00 | Calculated Property |
| η | 0.0006602 | Pa×s | 308.00 | Calculated Property |
| η | 0.0004727 | Pa×s | 337.00 | Calculated Property |
| η | 0.0003583 | Pa×s | 366.00 | Calculated Property |
| η | 0.0002842 | Pa×s | 395.00 | Calculated Property |
| η | 0.0002337 | Pa×s | 424.00 | Calculated Property |
| η | 0.0001980 | Pa×s | 453.00 | Calculated Property |
| η | 0.0001721 | Pa×s | 482.00 | Calculated Property |
| η | 0.0001527 | Pa×s | 511.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | [51.08; 2.57] | kJ/mol | [238.15; 611.40] |
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 | 6.52266e+01 | |||
| Coefficient B | 4.72207e-01 | |||
| Coefficient C | 2.38382e-01 | |||
| Coefficient D | -5.43690e-01 | |||
| Coefficient E | 2.22217e-01 | |||
| Critical temperature, Tc (K) | 6.11550e+02 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 611.40 | |||
| ΔvapH | 51.08 | kJ/mol | 238.15 | Calculated Property |
| ΔvapH | 48.38 | kJ/mol | 279.62 | Calculated Property |
| ΔvapH | 45.64 | kJ/mol | 321.09 | Calculated Property |
| ΔvapH | 42.80 | kJ/mol | 362.57 | Calculated Property |
| ΔvapH | 39.83 | kJ/mol | 404.04 | Calculated Property |
| ΔvapH | 36.60 | kJ/mol | 445.51 | Calculated Property |
| ΔvapH | 32.93 | kJ/mol | 486.98 | Calculated Property |
| ΔvapH | 28.45 | kJ/mol | 528.46 | Calculated Property |
| ΔvapH | 22.14 | kJ/mol | 569.93 | Calculated Property |
| ΔvapH | 2.57 | kJ/mol | 611.40 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [316.84; 450.01] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.50362e+01 | |||
| Coefficient B | -3.80179e+03 | |||
| Coefficient C | -5.90720e+01 | |||
| Temperature range, min. | 316.84 | |||
| Temperature range, max. | 450.01 | |||
| Pvap | 1.33 | kPa | 316.84 | Calculated Property |
| Pvap | 2.97 | kPa | 331.64 | Calculated Property |
| Pvap | 6.09 | kPa | 346.43 | Calculated Property |
| Pvap | 11.64 | kPa | 361.23 | Calculated Property |
| Pvap | 20.94 | kPa | 376.03 | Calculated Property |
| Pvap | 35.75 | kPa | 390.82 | Calculated Property |
| Pvap | 58.31 | kPa | 405.62 | Calculated Property |
| Pvap | 91.38 | kPa | 420.42 | Calculated Property |
| Pvap | 138.23 | kPa | 435.21 | Calculated Property |
| Pvap | 202.64 | kPa | 450.01 | Calculated Property |
| Pvap | [3.26e-03; 2922.19] | kPa | [238.15; 611.40] |
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 | 9.72243e+01 | |||
| Coefficient B | -8.93430e+03 | |||
| Coefficient C | -1.20263e+01 | |||
| Coefficient D | 6.75821e-06 | |||
| Coefficient E | 2.00000e+00 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 611.40 | |||
| Pvap | 3.26e-03 | kPa | 238.15 | Calculated Property |
| Pvap | 0.14 | kPa | 279.62 | Calculated Property |
| Pvap | 1.98 | kPa | 321.09 | Calculated Property |
| Pvap | 13.43 | kPa | 362.57 | Calculated Property |
| Pvap | 56.78 | kPa | 404.04 | Calculated Property |
| Pvap | 174.28 | kPa | 445.51 | Calculated Property |
| Pvap | 428.12 | kPa | 486.98 | Calculated Property |
| Pvap | 898.66 | kPa | 528.46 | Calculated Property |
| Pvap | 1686.48 | kPa | 569.93 | Calculated Property |
| Pvap | 2922.19 | kPa | 611.40 | Calculated Property |
| Pvap | [3.08e-03; 2843.45] | kPa | [238.15; 611.55] |
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 | 1.02039e+02 | |||
| Coefficient B | -9.16636e+03 | |||
| Coefficient C | -1.27418e+01 | |||
| Coefficient D | 7.09544e-06 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 611.55 | |||
| Pvap | 3.08e-03 | kPa | 238.15 | Calculated Property |
| Pvap | 0.14 | kPa | 279.64 | Calculated Property |
| Pvap | 1.98 | kPa | 321.13 | Calculated Property |
| Pvap | 13.49 | kPa | 362.62 | Calculated Property |
| Pvap | 56.98 | kPa | 404.11 | Calculated Property |
| Pvap | 174.08 | kPa | 445.59 | Calculated Property |
| Pvap | 424.93 | kPa | 487.08 | Calculated Property |
| Pvap | 885.80 | kPa | 528.57 | Calculated Property |
| Pvap | 1651.12 | kPa | 570.06 | Calculated Property |
| Pvap | 2843.45 | kPa | 611.55 | Calculated Property |
| Pvap | [0.13; 101.47] | kPa | [292.40; 423.40] |
NIST
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 2.12942e+01 | |||
| Coefficient B | -7.67161e+03 | |||
| Coefficient C | 3.66820e+01 | |||
| Reference | Stull, 1947 | |||
| Comment | Coefficents calculated by NIST from author's data. | |||
| Temperature range, min. | 292.40 | |||
| Temperature range, max. | 423.40 | |||
| Pvap | 0.13 | kPa | 292.40 | Calculated Property |
| Pvap | 0.36 | kPa | 306.96 | Calculated Property |
| Pvap | 0.88 | kPa | 321.51 | Calculated Property |
| Pvap | 2.04 | kPa | 336.07 | Calculated Property |
| Pvap | 4.42 | kPa | 350.62 | Calculated Property |
| Pvap | 9.06 | kPa | 365.18 | Calculated Property |
| Pvap | 17.66 | kPa | 379.73 | Calculated Property |
| Pvap | 32.90 | kPa | 394.29 | Calculated Property |
| Pvap | 58.85 | kPa | 408.84 | Calculated Property |
| Pvap | 101.47 | kPa | 423.40 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ρl | [860.05; 269.11] | kg/m3 | [238.15; 611.40] |
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 | 4.82959e+01 | |||
| Coefficient B | 2.16730e-01 | |||
| Coefficient C | 6.11550e+02 | |||
| Coefficient D | 2.51700e-01 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 611.40 | |||
| ρl | 860.05 | kg/m3 | 238.15 | Calculated Property |
| ρl | 826.80 | kg/m3 | 279.62 | Calculated Property |
| ρl | 791.75 | kg/m3 | 321.09 | Calculated Property |
| ρl | 754.48 | kg/m3 | 362.57 | Calculated Property |
| ρl | 714.34 | kg/m3 | 404.04 | Calculated Property |
| ρl | 670.34 | kg/m3 | 445.51 | Calculated Property |
| ρl | 620.75 | kg/m3 | 486.98 | Calculated Property |
| ρl | 562.10 | kg/m3 | 528.46 | Calculated Property |
| ρl | 484.88 | kg/m3 | 569.93 | Calculated Property |
| ρl | 269.11 | kg/m3 | 611.40 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| γ | [0.03; 0.01] | N/m | [238.15; 424.15] |
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 | 5.76046e-02 | |||
| Coefficient B | -1.05600e-04 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 424.15 | |||
| γ | 0.03 | N/m | 238.15 | Calculated Property |
| γ | 0.03 | N/m | 258.82 | Calculated Property |
| γ | 0.03 | N/m | 279.48 | Calculated Property |
| γ | 0.03 | N/m | 300.15 | Calculated Property |
| γ | 0.02 | N/m | 320.82 | Calculated Property |
| γ | 0.02 | N/m | 341.48 | Calculated Property |
| γ | 0.02 | N/m | 362.15 | Calculated Property |
| γ | 0.02 | N/m | 382.82 | Calculated Property |
| γ | 0.01 | N/m | 403.48 | Calculated Property |
| γ | 0.01 | N/m | 424.15 | Calculated Property |
| γ | [0.03; 6.36e-06] | N/m | [238.15; 607.67] |
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 | -6.81600e-03 | |||
| Coefficient B | 1.30100e+02 | |||
| Coefficient C | -4.08530e+00 | |||
| Coefficient D | 3.31920e-03 | |||
| Coefficient E | -8.48540e-06 | |||
| Comment | Range stopped where the equation turns negative; ChemSep gives it to 611.4 K. | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 607.67 | |||
| γ | 0.03 | N/m | 238.15 | Calculated Property |
| γ | 0.03 | N/m | 279.21 | Calculated Property |
| γ | 0.02 | N/m | 320.26 | Calculated Property |
| γ | 0.02 | N/m | 361.32 | Calculated Property |
| γ | 0.02 | N/m | 402.38 | Calculated Property |
| γ | 0.01 | N/m | 443.44 | Calculated Property |
| γ | 0.01 | N/m | 484.50 | Calculated Property |
| γ | 0.01 | N/m | 525.55 | Calculated Property |
| γ | 0.00 | N/m | 566.61 | Calculated Property |
| γ | 6.36e-06 | N/m | 607.67 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| λgas | [0.01; 0.11] | W/m×K | [238.15; 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 | 2.04730e+03 | |||
| Coefficient B | 1.03240e+00 | |||
| Coefficient C | 2.29700e+10 | |||
| Coefficient D | 7.80960e+08 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 1000.00 | |||
| λgas | 0.01 | W/m×K | 238.15 | Calculated Property |
| λgas | 0.01 | W/m×K | 322.80 | Calculated Property |
| λgas | 0.02 | W/m×K | 407.45 | Calculated Property |
| λgas | 0.03 | W/m×K | 492.10 | Calculated Property |
| λgas | 0.04 | W/m×K | 576.75 | Calculated Property |
| λgas | 0.05 | W/m×K | 661.40 | Calculated Property |
| λgas | 0.06 | W/m×K | 746.05 | Calculated Property |
| λgas | 0.08 | W/m×K | 830.70 | Calculated Property |
| λgas | 0.09 | W/m×K | 915.35 | Calculated Property |
| λgas | 0.11 | W/m×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| λliquid | [0.15; 0.11] | W/m×K | [238.15; 424.05] |
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 | 6.19160e-02 | |||
| Coefficient B | -1.62990e+02 | |||
| Coefficient C | -5.99840e-01 | |||
| Coefficient D | -4.40950e-03 | |||
| Coefficient E | -1.34150e-06 | |||
| Temperature range, min. | 238.15 | |||
| Temperature range, max. | 424.05 | |||
| λliquid | 0.15 | W/m×K | 238.15 | Calculated Property |
| λliquid | 0.15 | W/m×K | 258.81 | Calculated Property |
| λliquid | 0.14 | W/m×K | 279.46 | Calculated Property |
| λliquid | 0.14 | W/m×K | 300.12 | Calculated Property |
| λliquid | 0.13 | W/m×K | 320.77 | Calculated Property |
| λliquid | 0.13 | W/m×K | 341.43 | Calculated Property |
| λliquid | 0.12 | W/m×K | 362.08 | Calculated Property |
| λliquid | 0.12 | W/m×K | 382.74 | Calculated Property |
| λliquid | 0.11 | W/m×K | 403.39 | Calculated Property |
| λliquid | 0.11 | W/m×K | 424.05 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Heptanone.
Mixtures
- 2-Heptanone + Water
- Triethylamine + 2-Heptanone
- 1-Propanamine, N-propyl- + 2-Heptanone
- 1-Butanamine, N-butyl- + 2-Heptanone
- Ethane, 1,2-dichloro- + 2-Heptanone
- 2-Heptanone + Ethane, 1,1,2,2-tetrachloro-
- Formamide, N,N-dimethyl- + 2-Heptanone
- 1-Pentanol + 2-Heptanone
- 2-Heptanone + sodium sulphate + Water
- Tetrahydropyran + 2-Heptanone
- Octane + 2-Heptanone
- Nonane + 2-Heptanone
- Decane + 2-Heptanone
- 1-Octanol + 2-Heptanone
- 1-Decanol + 2-Heptanone
- 1-Dodecanol + 2-Heptanone
- sodium chloride + 2-Heptanone + Water
- Aniline + 2-Heptanone
- Aniline, N-methyl- + 2-Heptanone
- 1,3-Dioxolane + 2-Heptanone
Find more mixtures with 2-Heptanone.
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.
- A relative headspace method for Henry s constants of volatile organic compounds
- Vapour liquid equilibria, azeotropic data, excess enthalpies, activity coefficients at infinite dilution and solid liquid equilibria for binary alcohol ketone systems
- Thermodynamics of ketone + amine mixtures. Part IX. Excess molar enthalpies at 298.15K for dipropylamine, or dibutylamine + 2-alkanone systems and modeling of linear or aromatic amine + 2-alkanone mixtures in terms of DISQUAC and ERAS
- Thermodynamics of ketone + amine mixtures. Part X. Excess molarenthalpies at 298.15 K for N,N,N-triethylamine + 2-alkanone systems.Characterization of tertiary amine + 2-alkanone, and ofamino-ketone + n-alkane mixtures in terms of DISQUAC
- A thermodynamic study of the ketoreductase-catalyzed reduction of 2-alkanones in non-aqueous solvents
- Solubility of fragrance raw materials in water: Experimental study, correlations, and Mod. UNIFAC (Do) predictions
- Thermodynamics of (ketone + amine) mixtures. Part VI. Volumetric and speed of sound data at (293.15, 298.15, and 303.15) K for (2-heptanone + dipropylamine, +dibutylamine, or +triethylamine) systems
- Thermodynamics of amide + ketone mixtures. 1. Volumetric, speed of sound and refractive index data for N,N-dimethylformamide + 2-alkanone systems at several temperatures
- Improving the method of solution calorimetry for evaluation of the enthalpies of phase transitions and condensed state enthalpies of formation
- Volumetric properties of binary liquid mixtures of ketones with chloroalkanes at different temperatures and atmospheric pressure
- Examination of hydrogen-bonding interactions between dissolved solutes and alkylbenzene solvents based on Abraham model correlations derived from measured enthalpies of solvation
- Effect of halogen substitution on the enthalpies of solvation and hydrogen bonding of organic solutes in chlorobenzene and 1,2-dichlorobenzene derived using multi-parameter correlations
- Enthalpies of solution and enthalpies of solvation of organic solutes in ethylene glycol at 298.15 K: Prediction and analysis of intermolecular interaction contributions
- Determination of Activity Coefficients at Infinite Dilution of Solutes in N,N'-Di(2-ethylhexyl)isobutyramide Using Inverse Gas-Liquid Chromatography
- Thermodynamics of mixtures involving some linear or cyclic ketones and cyclic ethers. 2. Systems containing tetrahydropyran
- Thermodynamics of Mixtures Involving Some Linear or Cyclic Ketones and Cyclic Ethers. 3. Systems Containing 1,4-Dioxane
- Thermodynamics of Mixtures Involving Some Linear or Cyclic Ketones and Cyclic Ethers. 4. Systems Containing 1,3-Dioxolane
- Henry s Constants of 1-Alkanols and 2-Ketones in Salt Solutions
- Measurements, Correlations, and Mod. UNIFAC (Do) Prediction of (Solid-Liquid) Phase Equilibria Diagrams in Binary Systems (Aliphatic Ketone + an Alcohol)
- Thermodynamics of Ketone + Amine Mixtures. Part VIII. Molar Excess Enthalpies at 298.15 K for n-Alkanone + Aniline or + N-Methylaniline Systems
- Vapor Liquid Equilibria Measurements for the Nine n-Alkane/Ketone Pairs Comprising 2-, 3-, and 4-Heptanone with n-Octane, n-Nonane, and n-Decane
- KDB
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
- NCMS SOLV-DB
- The Yaws Handbook of Vapor Pressure
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