- InChI
- InChI=1S/C30H56O4/c1-4-5-6-7-8-9-10-11-12-13-16-19-22-26-33-29(31)23-20-17-14-15-18-21-24-30(32)34-27-25-28(2)3/h2,4-27H2,1,3H3
- InChI Key
- BXUARLAREHYKCG-UHFFFAOYSA-N
- Formula
- C30H56O4
- SMILES
-
C=C(C)CCOC(=O)CCCCCCCCC(=O)OCC
CCCCCCCCCCCCC - Molecular Weight1
- 480.76
- 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° | -186.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1036.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 76.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.10 | kJ/mol | Joback Calculated Property |
| log10WS | -9.96 | Crippen Calculated Property | |
| logPoct/wat | 9.251 | Crippen Calculated Property | |
| McVol | 444.140 | ml/mol | McGowan Calculated Property |
| Pc | 638.01 | kPa | Joback Calculated Property |
| Inp | 3360.00 | NIST | |
| Tboil | 1034.94 | K | Joback Calculated Property |
| Tc | 1294.63 | K | Joback Calculated Property |
| Tfus | 556.46 | K | Joback Calculated Property |
| Vc | 1.746 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1574.01; 1683.20] | J/mol×K | [1034.94; 1294.63] | 
|
| Cp,gas | 1574.01 | J/mol×K | 1034.94 | Joback Calculated Property |
| Cp,gas | 1597.51 | J/mol×K | 1078.22 | Joback Calculated Property |
| Cp,gas | 1618.73 | J/mol×K | 1121.50 | Joback Calculated Property |
| Cp,gas | 1637.79 | J/mol×K | 1164.79 | Joback Calculated Property |
| Cp,gas | 1654.81 | J/mol×K | 1208.07 | Joback Calculated Property |
| Cp,gas | 1669.91 | J/mol×K | 1251.35 | Joback Calculated Property |
| Cp,gas | 1683.20 | J/mol×K | 1294.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 3-methylbut-3-enyl pentadecyl ester.
Sources
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