- InChI
- InChI=1S/C14H16Cl2O2/c15-12-7-6-11(9-13(12)16)18-14(17)8-5-10-3-1-2-4-10/h6-7,9-10H,1-5,8H2
- InChI Key
- JPOVKVUFJRAFMA-UHFFFAOYSA-N
- Formula
- C14H16Cl2O2
- SMILES
-
O=C(CCC1CCCC1)Oc1ccc(Cl)c(Cl)c
1 - Molecular Weight1
- 287.18
- 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° | -61.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -334.50 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.54 | kJ/mol | Joback Calculated Property |
| log10WS | -5.32 | Crippen Calculated Property | |
| logPoct/wat | 4.869 | Crippen Calculated Property | |
| McVol | 205.420 | ml/mol | McGowan Calculated Property |
| Pc | 2248.26 | kPa | Joback Calculated Property |
| Inp | [2072.00; 2072.00] |
|
|
| Inp | 2072.00 | NIST | |
| Inp | 2072.00 | NIST | |
| Tboil | 722.79 | K | Joback Calculated Property |
| Tc | 957.71 | K | Joback Calculated Property |
| Tfus | 441.90 | K | Joback Calculated Property |
| Vc | 0.774 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [538.43; 614.61] | J/mol×K | [722.79; 957.71] |
|
| Cp,gas | 538.43 | J/mol×K | 722.79 | Joback Calculated Property |
| Cp,gas | 553.95 | J/mol×K | 761.94 | Joback Calculated Property |
| Cp,gas | 568.29 | J/mol×K | 801.10 | Joback Calculated Property |
| Cp,gas | 581.47 | J/mol×K | 840.25 | Joback Calculated Property |
| Cp,gas | 593.56 | J/mol×K | 879.40 | Joback Calculated Property |
| Cp,gas | 604.59 | J/mol×K | 918.56 | Joback Calculated Property |
| Cp,gas | 614.61 | J/mol×K | 957.71 | Joback Calculated Property |
| η | [0.0001847; 0.0012577] | Pa×s | [441.90; 722.79] |
|
| η | 0.0012577 | Pa×s | 441.90 | Joback Calculated Property |
| η | 0.0007838 | Pa×s | 488.71 | Joback Calculated Property |
| η | 0.0005306 | Pa×s | 535.53 | Joback Calculated Property |
| η | 0.0003824 | Pa×s | 582.35 | Joback Calculated Property |
| η | 0.0002894 | Pa×s | 629.16 | Joback Calculated Property |
| η | 0.0002276 | Pa×s | 675.97 | Joback Calculated Property |
| η | 0.0001847 | Pa×s | 722.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Cyclopentylpropionic acid, 3,4-dichlorophenyl ester.
Sources
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