- InChI
- InChI=1S/C19H31Cl3O4/c1-2-3-4-5-6-7-8-9-10-11-12-15-25-17(23)13-14-18(24)26-16-19(20,21)22/h13-14H,2-12,15-16H2,1H3/b14-13+
- InChI Key
- ZTXCYTUNNUJFBB-BUHFOSPRSA-N
- Formula
- C19H31Cl3O4
- SMILES
-
CCCCCCCCCCCCCOC(=O)C=CC(=O)OCC
(Cl)(Cl)Cl - Molecular Weight1
- 429.81
- 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° | -311.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -863.84 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.02 | kJ/mol | Joback Calculated Property |
| log10WS | -6.92 | Crippen Calculated Property | |
| logPoct/wat | 6.310 | Crippen Calculated Property | |
| McVol | 325.870 | ml/mol | McGowan Calculated Property |
| Pc | 1118.56 | kPa | Joback Calculated Property |
| Inp | [2684.00; 2684.00] |
|
|
| Inp | 2684.00 | NIST | |
| Inp | 2684.00 | NIST | |
| Tboil | 899.92 | K | Joback Calculated Property |
| Tc | 1105.02 | K | Joback Calculated Property |
| Tfus | 535.31 | K | Joback Calculated Property |
| Vc | 1.264 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [970.48; 1044.20] | J/mol×K | [899.92; 1105.02] |
|
| Cp,gas | 970.48 | J/mol×K | 899.92 | Joback Calculated Property |
| Cp,gas | 984.99 | J/mol×K | 934.10 | Joback Calculated Property |
| Cp,gas | 998.54 | J/mol×K | 968.29 | Joback Calculated Property |
| Cp,gas | 1011.18 | J/mol×K | 1002.47 | Joback Calculated Property |
| Cp,gas | 1022.96 | J/mol×K | 1036.65 | Joback Calculated Property |
| Cp,gas | 1033.95 | J/mol×K | 1070.83 | Joback Calculated Property |
| Cp,gas | 1044.20 | J/mol×K | 1105.02 | Joback Calculated Property |
| η | [0.0000256; 0.0003810] | Pa×s | [535.31; 899.92] |
|
| η | 0.0003810 | Pa×s | 535.31 | Joback Calculated Property |
| η | 0.0001932 | Pa×s | 596.08 | Joback Calculated Property |
| η | 0.0001111 | Pa×s | 656.85 | Joback Calculated Property |
| η | 0.0000701 | Pa×s | 717.62 | Joback Calculated Property |
| η | 0.0000476 | Pa×s | 778.38 | Joback Calculated Property |
| η | 0.0000341 | Pa×s | 839.15 | Joback Calculated Property |
| η | 0.0000256 | Pa×s | 899.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2,2,2-trichloroethyl tridecyl ester.
Sources
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