- InChI
- InChI=1S/C32H62O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-35-30(33)24-21-20-22-25-31(34)36-28-29(2)27-32(3,4)5/h29H,6-28H2,1-5H3
- InChI Key
- ZGVNBWLUBLWSBX-UHFFFAOYSA-N
- Formula
- C32H62O4
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)CCCCCC(
=O)OCC(C)CC(C)(C)C - Molecular Weight1
- 510.83
- 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).
- 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° | -248.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1207.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 73.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 103.45 | kJ/mol | Joback Calculated Property |
| log10WS | -10.46 | Crippen Calculated Property | |
| logPoct/wat | 9.967 | Crippen Calculated Property | |
| McVol | 476.620 | ml/mol | McGowan Calculated Property |
| Pc | 574.80 | kPa | Joback Calculated Property |
| Inp | [2811.00; 2811.00] |
|
|
| Inp | 2811.00 | NIST | |
| Inp | 2811.00 | NIST | |
| Tboil | 1080.47 | K | Joback Calculated Property |
| Tc | 1363.10 | K | Joback Calculated Property |
| Tfus | 582.14 | K | Joback Calculated Property |
| Vc | 1.859 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1736.71; 1853.50] | J/mol×K | [1080.47; 1363.10] |
|
| Cp,gas | 1736.71 | J/mol×K | 1080.47 | Joback Calculated Property |
| Cp,gas | 1761.88 | J/mol×K | 1127.57 | Joback Calculated Property |
| Cp,gas | 1784.50 | J/mol×K | 1174.68 | Joback Calculated Property |
| Cp,gas | 1804.77 | J/mol×K | 1221.78 | Joback Calculated Property |
| Cp,gas | 1822.90 | J/mol×K | 1268.89 | Joback Calculated Property |
| Cp,gas | 1839.08 | J/mol×K | 1315.99 | Joback Calculated Property |
| Cp,gas | 1853.50 | J/mol×K | 1363.10 | Joback Calculated Property |
| η | [0.0000056; 0.0001728] | Pa×s | [582.14; 1080.47] |
|
| η | 0.0001728 | Pa×s | 582.14 | Joback Calculated Property |
| η | 0.0000681 | Pa×s | 665.19 | Joback Calculated Property |
| η | 0.0000330 | Pa×s | 748.25 | Joback Calculated Property |
| η | 0.0000185 | Pa×s | 831.31 | Joback Calculated Property |
| η | 0.0000115 | Pa×s | 914.36 | Joback Calculated Property |
| η | 0.0000078 | Pa×s | 997.41 | Joback Calculated Property |
| η | 0.0000056 | Pa×s | 1080.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pimelic acid, heptadecyl 2,4,4-trimethylpentyl ester.
Sources
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