- InChI
- InChI=1S/C29H52O4/c1-3-4-5-6-7-8-9-10-11-12-13-18-23-32-28(30)25-20-15-16-21-26(25)29(31)33-27-22-17-14-19-24(27)2/h24-27H,3-23H2,1-2H3
- InChI Key
- CJGBNZHINCEPFU-UHFFFAOYSA-N
- Formula
- C29H52O4
- SMILES
-
CCCCCCCCCCCCCCOC(=O)C1CCCCC1C(
=O)OC1CCCCC1C - Molecular Weight1
- 464.72
- 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° | -241.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1063.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 62.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.70 | kJ/mol | Joback Calculated Property |
| log10WS | -8.86 | Crippen Calculated Property | |
| logPoct/wat | 8.159 | Crippen Calculated Property | |
| McVol | 412.630 | ml/mol | McGowan Calculated Property |
| Pc | 786.39 | kPa | Joback Calculated Property |
| Inp | [3264.00; 3264.00] |
|
|
| Inp | 3264.00 | NIST | |
| Inp | 3264.00 | NIST | |
| Tboil | 1045.26 | K | Joback Calculated Property |
| Tc | 1281.08 | K | Joback Calculated Property |
| Tfus | 567.19 | K | Joback Calculated Property |
| Vc | 1.571 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1538.68; 1615.49] | J/mol×K | [1045.26; 1281.08] |
|
| Cp,gas | 1538.68 | J/mol×K | 1045.26 | Joback Calculated Property |
| Cp,gas | 1557.42 | J/mol×K | 1084.56 | Joback Calculated Property |
| Cp,gas | 1573.71 | J/mol×K | 1123.87 | Joback Calculated Property |
| Cp,gas | 1587.59 | J/mol×K | 1163.17 | Joback Calculated Property |
| Cp,gas | 1599.14 | J/mol×K | 1202.48 | Joback Calculated Property |
| Cp,gas | 1608.42 | J/mol×K | 1241.78 | Joback Calculated Property |
| Cp,gas | 1615.49 | J/mol×K | 1281.08 | Joback Calculated Property |
| η | [0.0000259; 0.0004472] | Pa×s | [567.19; 1045.26] |
|
| η | 0.0004472 | Pa×s | 567.19 | Joback Calculated Property |
| η | 0.0002077 | Pa×s | 646.87 | Joback Calculated Property |
| η | 0.0001142 | Pa×s | 726.55 | Joback Calculated Property |
| η | 0.0000706 | Pa×s | 806.22 | Joback Calculated Property |
| η | 0.0000476 | Pa×s | 885.90 | Joback Calculated Property |
| η | 0.0000343 | Pa×s | 965.58 | Joback Calculated Property |
| η | 0.0000259 | Pa×s | 1045.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-methylcyclohexyl tetradecyl ester.
Sources
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