- InChI
- InChI=1S/C16H8Cl4O4/c17-9-1-3-11(4-2-9)23-14(21)5-6-15(22)24-16-12(19)7-10(18)8-13(16)20/h1-8H/b6-5+
- InChI Key
- YTZAOGZOZASQRM-AATRIKPKSA-N
- Formula
- C16H8Cl4O4
- SMILES
-
O=C(C=CC(=O)Oc1c(Cl)cc(Cl)cc1C
l)Oc1ccc(Cl)cc1 - Molecular Weight1
- 406.04
- 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° | -165.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -381.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.22 | kJ/mol | Joback Calculated Property |
| log10WS | -6.34 | Crippen Calculated Property | |
| logPoct/wat | 5.367 | Crippen Calculated Property | |
| McVol | 248.320 | ml/mol | McGowan Calculated Property |
| Pc | 2151.31 | kPa | Joback Calculated Property |
| Inp | [2799.00; 2799.00] |
|
|
| Inp | 2799.00 | NIST | |
| Inp | 2799.00 | NIST | |
| Tboil | 945.22 | K | Joback Calculated Property |
| Tc | 1199.71 | K | Joback Calculated Property |
| Tfus | 631.92 | K | Joback Calculated Property |
| Vc | 0.940 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [603.57; 633.89] | J/mol×K | [945.22; 1199.71] |
|
| Cp,gas | 603.57 | J/mol×K | 945.22 | Joback Calculated Property |
| Cp,gas | 611.11 | J/mol×K | 987.64 | Joback Calculated Property |
| Cp,gas | 617.60 | J/mol×K | 1030.05 | Joback Calculated Property |
| Cp,gas | 623.09 | J/mol×K | 1072.47 | Joback Calculated Property |
| Cp,gas | 627.60 | J/mol×K | 1114.88 | Joback Calculated Property |
| Cp,gas | 631.19 | J/mol×K | 1157.30 | Joback Calculated Property |
| Cp,gas | 633.89 | J/mol×K | 1199.71 | Joback Calculated Property |
| η | [0.0000506; 0.0002539] | Pa×s | [631.92; 945.22] |
|
| η | 0.0002539 | Pa×s | 631.92 | Joback Calculated Property |
| η | 0.0001751 | Pa×s | 684.14 | Joback Calculated Property |
| η | 0.0001273 | Pa×s | 736.35 | Joback Calculated Property |
| η | 0.0000965 | Pa×s | 788.57 | Joback Calculated Property |
| η | 0.0000758 | Pa×s | 840.79 | Joback Calculated Property |
| η | 0.0000612 | Pa×s | 893.00 | Joback Calculated Property |
| η | 0.0000506 | Pa×s | 945.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 4-chlorophenyl 2,4,6-trichlorophenyl ester.
Sources
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