- InChI
- InChI=1S/C27H50O4/c1-5-6-7-8-9-10-11-12-13-14-15-22-30-26(28)19-20-27(29)31-23-21-25(4)18-16-17-24(2)3/h17,25H,5-16,18-23H2,1-4H3
- InChI Key
- HCHIMNRQNKQVQM-UHFFFAOYSA-N
- Formula
- C27H50O4
- SMILES
-
CCCCCCCCCCCCCOC(=O)CCC(=O)OCCC
(C)CCC=C(C)C - Molecular Weight1
- 438.68
- Cp,gas : Ideal gas heat capacity (J/mol×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).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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 |
|---|---|---|---|
| ΔfG° | -222.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -988.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 66.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.66 | kJ/mol | Joback Calculated Property |
| log10WS | -8.46 | Crippen Calculated Property | |
| logPoct/wat | 7.937 | Crippen Calculated Property | |
| McVol | 401.870 | ml/mol | McGowan Calculated Property |
| Pc | 749.38 | kPa | Joback Calculated Property |
| Inp | 2960.00 | NIST | |
| Tboil | 973.34 | K | Joback Calculated Property |
| Tc | 1197.78 | K | Joback Calculated Property |
| Tfus | 504.33 | K | Joback Calculated Property |
| Vc | 1.571 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1381.77; 1485.98] | J/mol×K | [973.34; 1197.78] | 
|
| Cp,gas | 1381.77 | J/mol×K | 973.34 | Joback Calculated Property |
| Cp,gas | 1402.91 | J/mol×K | 1010.75 | Joback Calculated Property |
| Cp,gas | 1422.45 | J/mol×K | 1048.15 | Joback Calculated Property |
| Cp,gas | 1440.45 | J/mol×K | 1085.56 | Joback Calculated Property |
| Cp,gas | 1456.99 | J/mol×K | 1122.97 | Joback Calculated Property |
| Cp,gas | 1472.15 | J/mol×K | 1160.37 | Joback Calculated Property |
| Cp,gas | 1485.98 | J/mol×K | 1197.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 3,7-dimethyloct-6-en-1-yl tridecyl ester.
Sources
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