- InChI
- InChI=1S/C13H12Cl2O5/c1-18-9-4-2-3-5-10(9)20-13(17)7-6-12(16)19-8-11(14)15/h2-7,11H,8H2,1H3/b7-6+
- InChI Key
- ZVLDYCTWCDTEIN-VOTSOKGWSA-N
- Formula
- C13H12Cl2O5
- SMILES
-
COc1ccccc1OC(=O)C=CC(=O)OCC(Cl
)Cl - Molecular Weight1
- 319.14
- 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° | -357.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -627.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.53 | kJ/mol | Joback Calculated Property |
| log10WS | -3.21 | Crippen Calculated Property | |
| logPoct/wat | 2.504 | Crippen Calculated Property | |
| McVol | 211.200 | ml/mol | McGowan Calculated Property |
| Pc | 2291.52 | kPa | Joback Calculated Property |
| Inp | [2184.00; 2184.00] |
|
|
| Inp | 2184.00 | NIST | |
| Inp | 2184.00 | NIST | |
| Tboil | 782.08 | K | Joback Calculated Property |
| Tc | 1006.01 | K | Joback Calculated Property |
| Tfus | 481.52 | K | Joback Calculated Property |
| Vc | 0.793 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [537.02; 589.46] | J/mol×K | [782.08; 1006.01] |
|
| Cp,gas | 537.02 | J/mol×K | 782.08 | Joback Calculated Property |
| Cp,gas | 548.10 | J/mol×K | 819.40 | Joback Calculated Property |
| Cp,gas | 558.23 | J/mol×K | 856.72 | Joback Calculated Property |
| Cp,gas | 567.42 | J/mol×K | 894.05 | Joback Calculated Property |
| Cp,gas | 575.69 | J/mol×K | 931.37 | Joback Calculated Property |
| Cp,gas | 583.03 | J/mol×K | 968.69 | Joback Calculated Property |
| Cp,gas | 589.46 | J/mol×K | 1006.01 | Joback Calculated Property |
| η | [0.0000659; 0.0005828] | Pa×s | [481.52; 782.08] |
|
| η | 0.0005828 | Pa×s | 481.52 | Joback Calculated Property |
| η | 0.0003415 | Pa×s | 531.61 | Joback Calculated Property |
| η | 0.0002194 | Pa×s | 581.71 | Joback Calculated Property |
| η | 0.0001512 | Pa×s | 631.80 | Joback Calculated Property |
| η | 0.0001100 | Pa×s | 681.89 | Joback Calculated Property |
| η | 0.0000836 | Pa×s | 731.99 | Joback Calculated Property |
| η | 0.0000659 | Pa×s | 782.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2-methoxyphenyl 2,2-dichloroethyl ester.
Sources
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