- InChI
- InChI=1S/C19H25ClO4/c1-2-3-8-13-23-18(21)14-9-4-5-10-15(14)19(22)24-17-12-7-6-11-16(17)20/h6-7,11-12,14-15H,2-5,8-10,13H2,1H3
- InChI Key
- KPLPMJGMUYNOAR-UHFFFAOYSA-N
- Formula
- C19H25ClO4
- SMILES
-
CCCCCOC(=O)C1CCCCC1C(=O)Oc1ccc
cc1Cl - Molecular Weight1
- 352.85
- 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° | -251.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -681.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.64 | kJ/mol | Joback Calculated Property |
| log10WS | -5.35 | Crippen Calculated Property | |
| logPoct/wat | 4.785 | Crippen Calculated Property | |
| McVol | 271.070 | ml/mol | McGowan Calculated Property |
| Pc | 1601.28 | kPa | Joback Calculated Property |
| Inp | [2493.00; 2493.00] |
|
|
| Inp | 2493.00 | NIST | |
| Inp | 2493.00 | NIST | |
| Tboil | 870.67 | K | Joback Calculated Property |
| Tc | 1094.87 | K | Joback Calculated Property |
| Tfus | 520.21 | K | Joback Calculated Property |
| Vc | 1.020 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [844.76; 917.20] | J/mol×K | [870.67; 1094.87] |
|
| Cp,gas | 844.76 | J/mol×K | 870.67 | Joback Calculated Property |
| Cp,gas | 860.57 | J/mol×K | 908.04 | Joback Calculated Property |
| Cp,gas | 874.86 | J/mol×K | 945.40 | Joback Calculated Property |
| Cp,gas | 887.64 | J/mol×K | 982.77 | Joback Calculated Property |
| Cp,gas | 898.94 | J/mol×K | 1020.14 | Joback Calculated Property |
| Cp,gas | 908.79 | J/mol×K | 1057.50 | Joback Calculated Property |
| Cp,gas | 917.20 | J/mol×K | 1094.87 | Joback Calculated Property |
| η | [0.0000734; 0.0006746] | Pa×s | [520.21; 870.67] |
|
| η | 0.0006746 | Pa×s | 520.21 | Joback Calculated Property |
| η | 0.0003868 | Pa×s | 578.62 | Joback Calculated Property |
| η | 0.0002456 | Pa×s | 637.03 | Joback Calculated Property |
| η | 0.0001683 | Pa×s | 695.44 | Joback Calculated Property |
| η | 0.0001223 | Pa×s | 753.85 | Joback Calculated Property |
| η | 0.0000930 | Pa×s | 812.26 | Joback Calculated Property |
| η | 0.0000734 | Pa×s | 870.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-chlorophenyl pentyl ester.
Sources
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