- InChI
- InChI=1S/C26H48O4/c1-4-5-6-7-8-9-12-15-18-22-29-25(27)19-16-13-10-11-14-17-20-26(28)30-23-21-24(2)3/h21H,4-20,22-23H2,1-3H3
- InChI Key
- UZFCIOJYLVFSHX-UHFFFAOYSA-N
- Formula
- C26H48O4
- SMILES
-
CCCCCCCCCCCOC(=O)CCCCCCCCC(=O)
OCC=C(C)C - Molecular Weight1
- 424.66
- 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° | -228.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -962.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 67.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.82 | kJ/mol | Joback Calculated Property |
| log10WS | -8.28 | Crippen Calculated Property | |
| logPoct/wat | 7.691 | Crippen Calculated Property | |
| McVol | 387.780 | ml/mol | McGowan Calculated Property |
| Pc | 786.83 | kPa | Joback Calculated Property |
| Inp | 2992.00 | NIST | |
| Tboil | 950.90 | K | Joback Calculated Property |
| Tc | 1168.20 | K | Joback Calculated Property |
| Tfus | 508.06 | K | Joback Calculated Property |
| Vc | 1.520 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1317.19; 1420.28] | J/mol×K | [950.90; 1168.20] | 
|
| Cp,gas | 1317.19 | J/mol×K | 950.90 | Joback Calculated Property |
| Cp,gas | 1337.88 | J/mol×K | 987.12 | Joback Calculated Property |
| Cp,gas | 1357.08 | J/mol×K | 1023.33 | Joback Calculated Property |
| Cp,gas | 1374.86 | J/mol×K | 1059.55 | Joback Calculated Property |
| Cp,gas | 1391.28 | J/mol×K | 1095.77 | Joback Calculated Property |
| Cp,gas | 1406.39 | J/mol×K | 1131.98 | Joback Calculated Property |
| Cp,gas | 1420.28 | J/mol×K | 1168.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 3-methylbut-2-enyl undecyl ester.
Sources
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