- InChI
- InChI=1S/C29H45ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-23-33-28(31)24-19-14-15-20-25(24)29(32)34-27-22-17-16-21-26(27)30/h16-17,21-22,24-25H,2-15,18-20,23H2,1H3
- InChI Key
- GIALXPAJIWDMQC-UHFFFAOYSA-N
- Formula
- C29H45ClO4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)C1CCCCC1C
(=O)Oc1ccccc1Cl - Molecular Weight1
- 493.12
- 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° | -166.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -888.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 67.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.90 | kJ/mol | Joback Calculated Property |
| log10WS | -9.53 | Crippen Calculated Property | |
| logPoct/wat | 8.686 | Crippen Calculated Property | |
| McVol | 411.970 | ml/mol | McGowan Calculated Property |
| Pc | 835.79 | kPa | Joback Calculated Property |
| Inp | 3567.00 | NIST | |
| Tboil | 1099.47 | K | Joback Calculated Property |
| Tc | 1348.99 | K | Joback Calculated Property |
| Tfus | 632.91 | K | Joback Calculated Property |
| Vc | 1.581 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1454.10; 1513.01] | J/mol×K | [1099.47; 1348.99] | 
|
| Cp,gas | 1454.10 | J/mol×K | 1099.47 | Joback Calculated Property |
| Cp,gas | 1469.08 | J/mol×K | 1141.06 | Joback Calculated Property |
| Cp,gas | 1481.88 | J/mol×K | 1182.64 | Joback Calculated Property |
| Cp,gas | 1492.59 | J/mol×K | 1224.23 | Joback Calculated Property |
| Cp,gas | 1501.29 | J/mol×K | 1265.81 | Joback Calculated Property |
| Cp,gas | 1508.07 | J/mol×K | 1307.40 | Joback Calculated Property |
| Cp,gas | 1513.01 | J/mol×K | 1348.99 | Joback Calculated Property |
| η | [0.0000167; 0.0002139] | Pa×s | [632.91; 1099.47] |
|
| η | 0.0002139 | Pa×s | 632.91 | Joback Calculated Property |
| η | 0.0001107 | Pa×s | 710.67 | Joback Calculated Property |
| η | 0.0000653 | Pa×s | 788.43 | Joback Calculated Property |
| η | 0.0000423 | Pa×s | 866.19 | Joback Calculated Property |
| η | 0.0000295 | Pa×s | 943.95 | Joback Calculated Property |
| η | 0.0000217 | Pa×s | 1021.71 | Joback Calculated Property |
| η | 0.0000167 | Pa×s | 1099.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl pentadecyl ester.
Sources
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