- InChI
- InChI=1S/C15H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-15(17)18-14-13-16/h16H,2-14H2,1H3
- InChI Key
- FFSGAVLPIGSPIZ-UHFFFAOYSA-N
- Formula
- C15H30O3
- SMILES
- CCCCCCCCCCCCC(=O)OCCO
- Molecular Weight1
- 258.40
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- ΔvapH° : Enthalpy of vaporization at standard conditions (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).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 1.0213 | Relay (1.0) Calculated Property | |
| ΔfG° | -371.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -832.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.32 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.33 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.833 | Crippen Calculated Property | |
| McVol | 235.520 | ml/mol | McGowan Calculated Property |
| Pc | 1524.69 | kPa | Joback Calculated Property |
| Inp | [1914.00; 1914.00] |
|
|
| Inp | 1914.00 | NIST | |
| Inp | 1914.00 | NIST | |
| Tboil | 593.89 | K | Relay (1.0) Calculated Property |
| Tc | 777.27 | K | Relay (1.0) Calculated Property |
| Tfus | 305.09 | K | Relay (1.0) Calculated Property |
| Vc | 0.906 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [352.53; 819.97] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 1.99530e+01 | |||
| Coefficient B | 1.40802e+00 | |||
| Coefficient C | -7.28000e-04 | |||
| Coefficient D | 1.20000e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 352.53 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 432.28 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 504.19 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 568.64 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 626.01 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 676.69 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 721.04 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 759.45 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 792.30 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 819.97 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0045653; 0.0000674] | Pa×s | [361.96; 601.51] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.59765e+01 | |||
| Coefficient B | 3.83215e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 361.96 | |||
| Temperature range, max. | 601.51 | |||
| η | 0.0045653 | Pa×s | 361.96 | Calculated Property |
| η | 0.0022107 | Pa×s | 388.58 | Calculated Property |
| η | 0.0011748 | Pa×s | 415.19 | Calculated Property |
| η | 0.0006737 | Pa×s | 441.81 | Calculated Property |
| η | 0.0004116 | Pa×s | 468.43 | Calculated Property |
| η | 0.0002651 | Pa×s | 495.04 | Calculated Property |
| η | 0.0001786 | Pa×s | 521.66 | Calculated Property |
| η | 0.0001250 | Pa×s | 548.28 | Calculated Property |
| η | 0.0000905 | Pa×s | 574.89 | Calculated Property |
| η | 0.0000674 | Pa×s | 601.51 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Hydroxyethyl tridecanoate.
Sources
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