- InChI
- InChI=1S/C16H18Cl2O4/c1-2-21-15(19)11-5-3-4-6-12(11)16(20)22-14-9-10(17)7-8-13(14)18/h7-9,11-12H,2-6H2,1H3
- InChI Key
- RIAVCMRJFXTERK-UHFFFAOYSA-N
- Formula
- C16H18Cl2O4
- SMILES
-
CCOC(=O)C1CCCCC1C(=O)Oc1cc(Cl)
ccc1Cl - Molecular Weight1
- 345.22
- 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° | -297.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -647.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.01 | kJ/mol | Joback Calculated Property |
| log10WS | -4.78 | Crippen Calculated Property | |
| logPoct/wat | 4.268 | Crippen Calculated Property | |
| McVol | 241.040 | ml/mol | McGowan Calculated Property |
| Pc | 1952.68 | kPa | Joback Calculated Property |
| Inp | [2350.00; 2350.00] |
|
|
| Inp | 2350.00 | NIST | |
| Inp | 2350.00 | NIST | |
| Tboil | 844.44 | K | Joback Calculated Property |
| Tc | 1080.07 | K | Joback Calculated Property |
| Tfus | 528.84 | K | Joback Calculated Property |
| Vc | 0.901 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [696.04; 758.99] | J/mol×K | [844.44; 1080.07] |
|
| Cp,gas | 696.04 | J/mol×K | 844.44 | Joback Calculated Property |
| Cp,gas | 710.20 | J/mol×K | 883.71 | Joback Calculated Property |
| Cp,gas | 722.88 | J/mol×K | 922.98 | Joback Calculated Property |
| Cp,gas | 734.09 | J/mol×K | 962.26 | Joback Calculated Property |
| Cp,gas | 743.84 | J/mol×K | 1001.53 | Joback Calculated Property |
| Cp,gas | 752.14 | J/mol×K | 1040.80 | Joback Calculated Property |
| Cp,gas | 758.99 | J/mol×K | 1080.07 | Joback Calculated Property |
| η | [0.0000977; 0.0006600] | Pa×s | [528.84; 844.44] |
|
| η | 0.0006600 | Pa×s | 528.84 | Joback Calculated Property |
| η | 0.0004156 | Pa×s | 581.44 | Joback Calculated Property |
| η | 0.0002826 | Pa×s | 634.04 | Joback Calculated Property |
| η | 0.0002038 | Pa×s | 686.64 | Joback Calculated Property |
| η | 0.0001540 | Pa×s | 739.24 | Joback Calculated Property |
| η | 0.0001208 | Pa×s | 791.84 | Joback Calculated Property |
| η | 0.0000977 | Pa×s | 844.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2,5-dichlorophenyl ethyl ester.
Sources
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