- InChI
- InChI=1S/C20H20Cl2O4/c21-17-5-1-3-15(13-17)9-11-25-19(23)7-8-20(24)26-12-10-16-4-2-6-18(22)14-16/h1-6,13-14H,7-12H2
- InChI Key
- SPSPXJOGMONXQB-UHFFFAOYSA-N
- Formula
- C20H20Cl2O4
- SMILES
-
O=C(CCC(=O)OCCc1cccc(Cl)c1)OCC
c1cccc(Cl)c1 - Molecular Weight1
- 395.28
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 51.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 126.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.63 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.645 | Crippen Calculated Property | |
| McVol | 284.500 | ml/mol | McGowan Calculated Property |
| Inp | [2975.00; 2975.00] |
|
|
| Inp | 2975.00 | NIST | |
| Inp | 2975.00 | NIST | |
| Tboil | 685.50 | K | Relay (1.0) Calculated Property |
| Tfus | 319.10 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [816.20; 865.63] | J/mol×K | [911.82; 1139.58] |
|
| Cp,gas | 816.20 | J/mol×K | 911.82 | Joback Calculated Property |
| Cp,gas | 827.67 | J/mol×K | 949.78 | Joback Calculated Property |
| Cp,gas | 837.79 | J/mol×K | 987.74 | Joback Calculated Property |
| Cp,gas | 846.60 | J/mol×K | 1025.70 | Joback Calculated Property |
| Cp,gas | 854.15 | J/mol×K | 1063.66 | Joback Calculated Property |
| Cp,gas | 860.48 | J/mol×K | 1101.62 | Joback Calculated Property |
| Cp,gas | 865.63 | J/mol×K | 1139.58 | Joback Calculated Property |
| η | [0.0000321; 0.0003927] | Pa×s | [537.54; 911.82] |
|
| η | 0.0003927 | Pa×s | 537.54 | Joback Calculated Property |
| η | 0.0002082 | Pa×s | 599.92 | Joback Calculated Property |
| η | 0.0001244 | Pa×s | 662.30 | Joback Calculated Property |
| η | 0.0000812 | Pa×s | 724.68 | Joback Calculated Property |
| η | 0.0000567 | Pa×s | 787.06 | Joback Calculated Property |
| η | 0.0000418 | Pa×s | 849.44 | Joback Calculated Property |
| η | 0.0000321 | Pa×s | 911.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, di(3-chlorophenethyl) ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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