- InChI
- InChI=1S/C19H36O2/c1-3-5-7-9-11-12-13-15-17-19(20)21-18-16-14-10-8-6-4-2/h3H,1,4-18H2,2H3
- InChI Key
- PKLGTKSKHJFCIX-UHFFFAOYSA-N
- Formula
- C19H36O2
- SMILES
- C=CCCCCCCCCC(=O)OCCCCCCCC
- Molecular Weight1
- 296.49
- CAS
- 28080-85-5
- 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).
- 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 | 0.8931 | Relay (1.0) Calculated Property | |
| ΔfG° | -113.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -651.69 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 48.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.46 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.08 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.197 | Crippen Calculated Property | |
| McVol | 281.710 | ml/mol | McGowan Calculated Property |
| Pc | 1114.82 | kPa | Joback Calculated Property |
| Tboil | 609.55 | K | Relay (1.0) Calculated Property |
| Tc | 775.10 | K | Relay (1.0) Calculated Property |
| Tfus | 271.02 | K | Relay (1.0) Calculated Property |
| Vc | 1.071 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [814.90; 915.43] | J/mol×K | [689.22; 857.10] | 
|
| Cp,gas | 814.90 | J/mol×K | 689.22 | Joback Calculated Property |
| Cp,gas | 833.77 | J/mol×K | 717.20 | Joback Calculated Property |
| Cp,gas | 851.77 | J/mol×K | 745.18 | Joback Calculated Property |
| Cp,gas | 868.91 | J/mol×K | 773.16 | Joback Calculated Property |
| Cp,gas | 885.22 | J/mol×K | 801.14 | Joback Calculated Property |
| Cp,gas | 900.72 | J/mol×K | 829.12 | Joback Calculated Property |
| Cp,gas | 915.43 | J/mol×K | 857.10 | Joback Calculated Property |
| η | [0.0000792; 0.0026751] | Pa×s | [344.46; 689.22] |
|
| η | 0.0026751 | Pa×s | 344.46 | Joback Calculated Property |
| η | 0.0009782 | Pa×s | 401.92 | Joback Calculated Property |
| η | 0.0004600 | Pa×s | 459.38 | Joback Calculated Property |
| η | 0.0002559 | Pa×s | 516.84 | Joback Calculated Property |
| η | 0.0001600 | Pa×s | 574.30 | Joback Calculated Property |
| η | 0.0001090 | Pa×s | 631.76 | Joback Calculated Property |
| η | 0.0000792 | Pa×s | 689.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 10-Undecenoic acid, octyl ester.
Sources
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