- InChI
- InChI=1S/C10H13Cl3O4/c1-2-3-6-16-8(14)4-5-9(15)17-7-10(11,12)13/h4-5H,2-3,6-7H2,1H3/b5-4+
- InChI Key
- ZAVMYKKEQJIFPH-SNAWJCMRSA-N
- Formula
- C10H13Cl3O4
- SMILES
-
CCCCOC(=O)C=CC(=O)OCC(Cl)(Cl)C
l - Molecular Weight1
- 303.57
- 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° | -387.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -678.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.98 | kJ/mol | Joback Calculated Property |
| log10WS | -3.15 | Crippen Calculated Property | |
| logPoct/wat | 2.799 | Crippen Calculated Property | |
| McVol | 199.060 | ml/mol | McGowan Calculated Property |
| Pc | 2212.45 | kPa | Joback Calculated Property |
| Inp | [1768.00; 1768.00] |
|
|
| Inp | 1768.00 | NIST | |
| Inp | 1768.00 | NIST | |
| Tboil | 694.00 | K | Joback Calculated Property |
| Tc | 902.76 | K | Joback Calculated Property |
| Tfus | 433.88 | K | Joback Calculated Property |
| Vc | 0.759 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [474.31; 528.26] | J/mol×K | [694.00; 902.76] |
|
| Cp,gas | 474.31 | J/mol×K | 694.00 | Joback Calculated Property |
| Cp,gas | 485.01 | J/mol×K | 728.79 | Joback Calculated Property |
| Cp,gas | 494.99 | J/mol×K | 763.59 | Joback Calculated Property |
| Cp,gas | 504.28 | J/mol×K | 798.38 | Joback Calculated Property |
| Cp,gas | 512.89 | J/mol×K | 833.17 | Joback Calculated Property |
| Cp,gas | 520.88 | J/mol×K | 867.96 | Joback Calculated Property |
| Cp,gas | 528.26 | J/mol×K | 902.76 | Joback Calculated Property |
| η | [0.0001037; 0.0010864] | Pa×s | [433.88; 694.00] |
|
| η | 0.0010864 | Pa×s | 433.88 | Joback Calculated Property |
| η | 0.0006148 | Pa×s | 477.23 | Joback Calculated Property |
| η | 0.0003825 | Pa×s | 520.59 | Joback Calculated Property |
| η | 0.0002560 | Pa×s | 563.94 | Joback Calculated Property |
| η | 0.0001814 | Pa×s | 607.29 | Joback Calculated Property |
| η | 0.0001346 | Pa×s | 650.65 | Joback Calculated Property |
| η | 0.0001037 | Pa×s | 694.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, butyl 2,2,2-trichloroethyl ester.
Sources
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