- InChI
- InChI=1S/C14H23ClO4/c1-10(2)9-19-14(17)12-6-4-3-5-11(12)13(16)18-8-7-15/h10-12H,3-9H2,1-2H3
- InChI Key
- VZDFGACGGMQVTK-UHFFFAOYSA-N
- Formula
- C14H23ClO4
- SMILES
- CC(C)COC(=O)C1CCCCC1C(=O)OCCCl
- Molecular Weight1
- 290.78
- 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° | -398.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -808.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.19 | kJ/mol | Joback Calculated Property |
| log10WS | -2.73 | Crippen Calculated Property | |
| logPoct/wat | 2.774 | Crippen Calculated Property | |
| McVol | 224.380 | ml/mol | McGowan Calculated Property |
| Pc | 1846.75 | kPa | Joback Calculated Property |
| Inp | [1916.00; 1916.00] |
|
|
| Inp | 1916.00 | NIST | |
| Inp | 1916.00 | NIST | |
| Tboil | 724.17 | K | Joback Calculated Property |
| Tc | 930.67 | K | Joback Calculated Property |
| Tfus | 409.92 | K | Joback Calculated Property |
| Vc | 0.843 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [649.70; 737.05] | J/mol×K | [724.17; 930.67] |
|
| Cp,gas | 649.70 | J/mol×K | 724.17 | Joback Calculated Property |
| Cp,gas | 667.13 | J/mol×K | 758.59 | Joback Calculated Property |
| Cp,gas | 683.40 | J/mol×K | 793.00 | Joback Calculated Property |
| Cp,gas | 698.53 | J/mol×K | 827.42 | Joback Calculated Property |
| Cp,gas | 712.51 | J/mol×K | 861.84 | Joback Calculated Property |
| Cp,gas | 725.35 | J/mol×K | 896.25 | Joback Calculated Property |
| Cp,gas | 737.05 | J/mol×K | 930.67 | Joback Calculated Property |
| η | [0.0001273; 0.0017048] | Pa×s | [409.92; 724.17] |
|
| η | 0.0017048 | Pa×s | 409.92 | Joback Calculated Property |
| η | 0.0008659 | Pa×s | 462.30 | Joback Calculated Property |
| η | 0.0005049 | Pa×s | 514.67 | Joback Calculated Property |
| η | 0.0003252 | Pa×s | 567.04 | Joback Calculated Property |
| η | 0.0002256 | Pa×s | 619.42 | Joback Calculated Property |
| η | 0.0001657 | Pa×s | 671.79 | Joback Calculated Property |
| η | 0.0001273 | Pa×s | 724.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-chloroethyl isobutyl ester.
Sources
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