- InChI
- InChI=1S/C19H26Cl2O4/c20-13-5-3-1-2-4-6-14-24-18(22)11-12-19(23)25-15-16-7-9-17(21)10-8-16/h7-10H,1-6,11-15H2
- InChI Key
- QYJFTIJCTDICOQ-UHFFFAOYSA-N
- Formula
- C19H26Cl2O4
- SMILES
-
O=C(CCC(=O)OCc1ccc(Cl)cc1)OCCC
CCCCCCl - Molecular Weight1
- 389.31
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -837.59 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 55.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 116.03 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.286 | Crippen Calculated Property | |
| McVol | 294.170 | ml/mol | McGowan Calculated Property |
| Inp | [2984.00; 2984.00] |
|
|
| Inp | 2984.00 | NIST | |
| Inp | 2984.00 | NIST | |
| Tfus | 299.69 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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 | [860.75; 926.31] | J/mol×K | [857.28; 1061.53] |
|
| Cp,gas | 860.75 | J/mol×K | 857.28 | Joback Calculated Property |
| Cp,gas | 874.52 | J/mol×K | 891.32 | Joback Calculated Property |
| Cp,gas | 887.11 | J/mol×K | 925.36 | Joback Calculated Property |
| Cp,gas | 898.56 | J/mol×K | 959.40 | Joback Calculated Property |
| Cp,gas | 908.89 | J/mol×K | 993.45 | Joback Calculated Property |
| Cp,gas | 918.13 | J/mol×K | 1027.49 | Joback Calculated Property |
| Cp,gas | 926.31 | J/mol×K | 1061.53 | Joback Calculated Property |
| η | [0.0000359; 0.0006133] | Pa×s | [487.33; 857.28] |
|
| η | 0.0006133 | Pa×s | 487.33 | Joback Calculated Property |
| η | 0.0002931 | Pa×s | 548.99 | Joback Calculated Property |
| η | 0.0001626 | Pa×s | 610.65 | Joback Calculated Property |
| η | 0.0001005 | Pa×s | 672.30 | Joback Calculated Property |
| η | 0.0000673 | Pa×s | 733.96 | Joback Calculated Property |
| η | 0.0000480 | Pa×s | 795.62 | Joback Calculated Property |
| η | 0.0000359 | Pa×s | 857.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 8-chlorooctyl 4-chlorobenzyl 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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