- InChI
- InChI=1S/C19H15Cl3O4/c1-2-16(12-6-4-3-5-7-12)25-17(23)8-9-18(24)26-19-14(21)10-13(20)11-15(19)22/h3-11,16H,2H2,1H3/b9-8+
- InChI Key
- YLMWLFUPPNSIHN-CMDGGOBGSA-N
- Formula
- C19H15Cl3O4
- SMILES
-
CCC(OC(=O)C=CC(=O)Oc1c(Cl)cc(C
l)cc1Cl)c1ccccc1 - Molecular Weight1
- 413.68
- 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° | -120.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -421.72 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.46 | kJ/mol | Joback Calculated Property |
| log10WS | -6.72 | Crippen Calculated Property | |
| logPoct/wat | 5.803 | Crippen Calculated Property | |
| McVol | 278.350 | ml/mol | McGowan Calculated Property |
| Pc | 1759.49 | kPa | Joback Calculated Property |
| Inp | [2771.00; 2771.00] |
|
|
| Inp | 2771.00 | NIST | |
| Inp | 2771.00 | NIST | |
| Tboil | 971.01 | K | Joback Calculated Property |
| Tc | 1216.87 | K | Joback Calculated Property |
| Tfus | 608.29 | K | Joback Calculated Property |
| Vc | 1.052 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [756.26; 797.89] | J/mol×K | [971.01; 1216.87] |
|
| Cp,gas | 756.26 | J/mol×K | 971.01 | Joback Calculated Property |
| Cp,gas | 765.89 | J/mol×K | 1011.99 | Joback Calculated Property |
| Cp,gas | 774.36 | J/mol×K | 1052.96 | Joback Calculated Property |
| Cp,gas | 781.74 | J/mol×K | 1093.94 | Joback Calculated Property |
| Cp,gas | 788.09 | J/mol×K | 1134.92 | Joback Calculated Property |
| Cp,gas | 793.45 | J/mol×K | 1175.90 | Joback Calculated Property |
| Cp,gas | 797.89 | J/mol×K | 1216.87 | Joback Calculated Property |
| η | [0.0000341; 0.0002555] | Pa×s | [608.29; 971.01] |
|
| η | 0.0002555 | Pa×s | 608.29 | Joback Calculated Property |
| η | 0.0001570 | Pa×s | 668.74 | Joback Calculated Property |
| η | 0.0001046 | Pa×s | 729.20 | Joback Calculated Property |
| η | 0.0000741 | Pa×s | 789.65 | Joback Calculated Property |
| η | 0.0000552 | Pa×s | 850.10 | Joback Calculated Property |
| η | 0.0000427 | Pa×s | 910.56 | Joback Calculated Property |
| η | 0.0000341 | Pa×s | 971.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 1-phenylprop-1-yl 2,4,6-trichlorophenyl ester.
Sources
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