- InChI
- InChI=1S/C32H62O4/c1-6-7-8-9-10-11-12-13-14-15-18-21-24-27-35-30(33)25-22-19-16-17-20-23-26-31(34)36-32(28(2)3)29(4)5/h28-29,32H,6-27H2,1-5H3
- InChI Key
- IQDRZKWTALQNIE-UHFFFAOYSA-N
- Formula
- C32H62O4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)CCCCCCCCC
(=O)OC(C(C)C)C(C)C - Molecular Weight1
- 510.83
- 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 | 1.3684 | Relay (1.0) Calculated Property | |
| ΔfG° | -256.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1317.54 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 73.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 134.39 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.71 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.63 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.965 | Crippen Calculated Property | |
| McVol | 476.620 | ml/mol | McGowan Calculated Property |
| Pc | 573.98 | kPa | Joback Calculated Property |
| Inp | 3437.00 | NIST | |
| Tboil | 687.27 | K | Relay (1.0) Calculated Property |
| Tc | 862.52 | K | Relay (1.0) Calculated Property |
| Tfus | 298.67 | K | Relay (1.0) Calculated Property |
| Vc | 1.806 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1737.08; 1843.40] | J/mol×K | [1082.82; 1370.02] | 
|
| Cp,gas | 1737.08 | J/mol×K | 1082.82 | Joback Calculated Property |
| Cp,gas | 1761.73 | J/mol×K | 1130.69 | Joback Calculated Property |
| Cp,gas | 1783.41 | J/mol×K | 1178.55 | Joback Calculated Property |
| Cp,gas | 1802.25 | J/mol×K | 1226.42 | Joback Calculated Property |
| Cp,gas | 1818.43 | J/mol×K | 1274.29 | Joback Calculated Property |
| Cp,gas | 1832.09 | J/mol×K | 1322.15 | Joback Calculated Property |
| Cp,gas | 1843.40 | J/mol×K | 1370.02 | Joback Calculated Property |
| η | [0.0000062; 0.0002592] | Pa×s | [549.72; 1082.82] |
|
| η | 0.0002592 | Pa×s | 549.72 | Joback Calculated Property |
| η | 0.0000901 | Pa×s | 638.57 | Joback Calculated Property |
| η | 0.0000406 | Pa×s | 727.42 | Joback Calculated Property |
| η | 0.0000217 | Pa×s | 816.27 | Joback Calculated Property |
| η | 0.0000132 | Pa×s | 905.12 | Joback Calculated Property |
| η | 0.0000087 | Pa×s | 993.97 | Joback Calculated Property |
| η | 0.0000062 | Pa×s | 1082.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 2,4-dimethylpent-3-yl pentadecyl ester.
Sources
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