- InChI
- InChI=1S/C10H13Cl3O4/c1-7(2)5-16-8(14)3-4-9(15)17-6-10(11,12)13/h3-4,7H,5-6H2,1-2H3/b4-3+
- InChI Key
- VYCVEXWSKPJYKF-ONEGZZNKSA-N
- Formula
- C10H13Cl3O4
- SMILES
-
CC(C)COC(=O)C=CC(=O)OCC(Cl)(Cl
)Cl - 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° | -389.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -683.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.59 | kJ/mol | Joback Calculated Property |
| log10WS | -2.91 | Crippen Calculated Property | |
| logPoct/wat | 2.655 | Crippen Calculated Property | |
| McVol | 199.060 | ml/mol | McGowan Calculated Property |
| Pc | 2229.20 | kPa | Joback Calculated Property |
| Inp | [1718.00; 1718.00] |
|
|
| Inp | 1718.00 | NIST | |
| Inp | 1718.00 | NIST | |
| Tboil | 693.56 | K | Joback Calculated Property |
| Tc | 906.02 | K | Joback Calculated Property |
| Tfus | 418.88 | K | Joback Calculated Property |
| Vc | 0.753 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [474.88; 529.61] | J/mol×K | [693.56; 906.02] |
|
| Cp,gas | 474.88 | J/mol×K | 693.56 | Joback Calculated Property |
| Cp,gas | 485.81 | J/mol×K | 728.97 | Joback Calculated Property |
| Cp,gas | 495.96 | J/mol×K | 764.38 | Joback Calculated Property |
| Cp,gas | 505.39 | J/mol×K | 799.79 | Joback Calculated Property |
| Cp,gas | 514.12 | J/mol×K | 835.20 | Joback Calculated Property |
| Cp,gas | 522.18 | J/mol×K | 870.61 | Joback Calculated Property |
| Cp,gas | 529.61 | J/mol×K | 906.02 | Joback Calculated Property |
| η | [0.0000960; 0.0013016] | Pa×s | [418.88; 693.56] |
|
| η | 0.0013016 | Pa×s | 418.88 | Joback Calculated Property |
| η | 0.0006805 | Pa×s | 464.66 | Joback Calculated Property |
| η | 0.0003997 | Pa×s | 510.44 | Joback Calculated Property |
| η | 0.0002562 | Pa×s | 556.22 | Joback Calculated Property |
| η | 0.0001758 | Pa×s | 602.00 | Joback Calculated Property |
| η | 0.0001272 | Pa×s | 647.78 | Joback Calculated Property |
| η | 0.0000960 | Pa×s | 693.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, isobutyl 2,2,2-trichloroethyl ester.
Sources
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