- InChI
- InChI=1S/C23H42O4/c1-3-5-7-9-11-15-19-27-23(25)21-17-13-12-16-20(21)22(24)26-18-14-10-8-6-4-2/h20-21H,3-19H2,1-2H3
- InChI Key
- STURPVSRWWYUMZ-UHFFFAOYSA-N
- Formula
- C23H42O4
- SMILES
-
CCCCCCCCOC(=O)C1CCCCC1C(=O)OCC
CCCCC - Molecular Weight1
- 382.58
- 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° | -308.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -973.67 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.22 | kJ/mol | Joback Calculated Property |
| log10WS | -6.59 | Crippen Calculated Property | |
| logPoct/wat | 6.210 | Crippen Calculated Property | |
| McVol | 338.950 | ml/mol | McGowan Calculated Property |
| Pc | 1000.18 | kPa | Joback Calculated Property |
| Inp | [2623.00; 2623.00] |
|
|
| Inp | 2623.00 | NIST | |
| Inp | 2623.00 | NIST | |
| Tboil | 893.10 | K | Joback Calculated Property |
| Tc | 1095.01 | K | Joback Calculated Property |
| Tfus | 496.43 | K | Joback Calculated Property |
| Vc | 1.304 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1155.63; 1251.01] | J/mol×K | [893.10; 1095.01] |
|
| Cp,gas | 1155.63 | J/mol×K | 893.10 | Joback Calculated Property |
| Cp,gas | 1175.24 | J/mol×K | 926.75 | Joback Calculated Property |
| Cp,gas | 1193.32 | J/mol×K | 960.40 | Joback Calculated Property |
| Cp,gas | 1209.91 | J/mol×K | 994.05 | Joback Calculated Property |
| Cp,gas | 1225.04 | J/mol×K | 1027.71 | Joback Calculated Property |
| Cp,gas | 1238.73 | J/mol×K | 1061.36 | Joback Calculated Property |
| Cp,gas | 1251.01 | J/mol×K | 1095.01 | Joback Calculated Property |
| η | [0.0000462; 0.0007325] | Pa×s | [496.43; 893.10] |
|
| η | 0.0007325 | Pa×s | 496.43 | Joback Calculated Property |
| η | 0.0003525 | Pa×s | 562.54 | Joback Calculated Property |
| η | 0.0001979 | Pa×s | 628.65 | Joback Calculated Property |
| η | 0.0001240 | Pa×s | 694.76 | Joback Calculated Property |
| η | 0.0000842 | Pa×s | 760.88 | Joback Calculated Property |
| η | 0.0000609 | Pa×s | 826.99 | Joback Calculated Property |
| η | 0.0000462 | Pa×s | 893.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, heptyl octyl ester.
Sources
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