- InChI
- InChI=1S/C12H7Cl5O4/c1-2-20-5(18)3-4-6(19)21-12-10(16)8(14)7(13)9(15)11(12)17/h3-4H,2H2,1H3/b4-3+
- InChI Key
- MSJGEMUIWSXWBP-ONEGZZNKSA-N
- Formula
- C12H7Cl5O4
- SMILES
-
CCOC(=O)C=CC(=O)Oc1c(Cl)c(Cl)c
(Cl)c(Cl)c1Cl - Molecular Weight1
- 392.45
- 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° | -332.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -562.91 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.09 | kJ/mol | Joback Calculated Property |
| log10WS | -5.60 | Crippen Calculated Property | |
| logPoct/wat | 4.978 | Crippen Calculated Property | |
| McVol | 227.960 | ml/mol | McGowan Calculated Property |
| Pc | 2153.30 | kPa | Joback Calculated Property |
| Inp | [2474.00; 2474.00] |
|
|
| Inp | 2474.00 | NIST | |
| Inp | 2474.00 | NIST | |
| Tboil | 869.43 | K | Joback Calculated Property |
| Tc | 1106.28 | K | Joback Calculated Property |
| Tfus | 602.86 | K | Joback Calculated Property |
| Vc | 0.873 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [509.35; 541.19] | J/mol×K | [869.43; 1106.28] |
|
| Cp,gas | 509.35 | J/mol×K | 869.43 | Joback Calculated Property |
| Cp,gas | 516.67 | J/mol×K | 908.91 | Joback Calculated Property |
| Cp,gas | 523.19 | J/mol×K | 948.38 | Joback Calculated Property |
| Cp,gas | 528.91 | J/mol×K | 987.86 | Joback Calculated Property |
| Cp,gas | 533.81 | J/mol×K | 1027.33 | Joback Calculated Property |
| Cp,gas | 537.91 | J/mol×K | 1066.81 | Joback Calculated Property |
| Cp,gas | 541.19 | J/mol×K | 1106.28 | Joback Calculated Property |
| η | [0.0000751; 0.0003100] | Pa×s | [602.86; 869.43] |
|
| η | 0.0003100 | Pa×s | 602.86 | Joback Calculated Property |
| η | 0.0002257 | Pa×s | 647.29 | Joback Calculated Property |
| η | 0.0001712 | Pa×s | 691.72 | Joback Calculated Property |
| η | 0.0001342 | Pa×s | 736.14 | Joback Calculated Property |
| η | 0.0001082 | Pa×s | 780.57 | Joback Calculated Property |
| η | 0.0000893 | Pa×s | 825.00 | Joback Calculated Property |
| η | 0.0000751 | Pa×s | 869.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, ethyl pentachlorophenyl ester.
Sources
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