- InChI
- InChI=1S/C26H48O4/c1-4-5-6-7-8-9-10-11-12-13-14-17-20-29-25(27)23-18-15-16-19-24(23)26(28)30-21-22(2)3/h22-24H,4-21H2,1-3H3
- InChI Key
- HNIYTQZUWSFMTE-UHFFFAOYSA-N
- Formula
- C26H48O4
- SMILES
-
CCCCCCCCCCCCCCOC(=O)C1CCCCC1C(
=O)OCC(C)C - Molecular Weight1
- 424.66
- 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° | -285.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1040.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.51 | kJ/mol | Joback Calculated Property |
| log10WS | -7.60 | Crippen Calculated Property | |
| logPoct/wat | 7.236 | Crippen Calculated Property | |
| McVol | 381.220 | ml/mol | McGowan Calculated Property |
| Pc | 844.07 | kPa | Joback Calculated Property |
| Inp | [2902.00; 2902.00] |
|
|
| Inp | 2902.00 | NIST | |
| Inp | 2902.00 | NIST | |
| Tboil | 961.30 | K | Joback Calculated Property |
| Tc | 1177.22 | K | Joback Calculated Property |
| Tfus | 515.24 | K | Joback Calculated Property |
| Vc | 1.466 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1346.53; 1440.11] | J/mol×K | [961.30; 1177.22] |
|
| Cp,gas | 1346.53 | J/mol×K | 961.30 | Joback Calculated Property |
| Cp,gas | 1366.57 | J/mol×K | 997.29 | Joback Calculated Property |
| Cp,gas | 1384.77 | J/mol×K | 1033.27 | Joback Calculated Property |
| Cp,gas | 1401.18 | J/mol×K | 1069.26 | Joback Calculated Property |
| Cp,gas | 1415.85 | J/mol×K | 1105.24 | Joback Calculated Property |
| Cp,gas | 1428.81 | J/mol×K | 1141.23 | Joback Calculated Property |
| Cp,gas | 1440.11 | J/mol×K | 1177.22 | Joback Calculated Property |
| η | [0.0000269; 0.0005807] | Pa×s | [515.24; 961.30] |
|
| η | 0.0005807 | Pa×s | 515.24 | Joback Calculated Property |
| η | 0.0002521 | Pa×s | 589.58 | Joback Calculated Property |
| η | 0.0001319 | Pa×s | 663.93 | Joback Calculated Property |
| η | 0.0000787 | Pa×s | 738.27 | Joback Calculated Property |
| η | 0.0000516 | Pa×s | 812.61 | Joback Calculated Property |
| η | 0.0000363 | Pa×s | 886.96 | Joback Calculated Property |
| η | 0.0000269 | Pa×s | 961.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, isobutyl tetradecyl ester.
Sources
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