- InChI
- InChI=1S/C14H12Cl4O4/c1-7(2)6-21-10(19)3-4-11(20)22-9-5-8(15)12(16)14(18)13(9)17/h3-5,7H,6H2,1-2H3/b4-3+
- InChI Key
- LSWQEYJKXOOGPU-ONEGZZNKSA-N
- Formula
- C14H12Cl4O4
- SMILES
-
CC(C)COC(=O)C=CC(=O)Oc1cc(Cl)c
(Cl)c(Cl)c1Cl - Molecular Weight1
- 386.06
- 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° | -296.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -582.26 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.10 | kJ/mol | Joback Calculated Property |
| log10WS | -5.51 | Crippen Calculated Property | |
| logPoct/wat | 4.961 | Crippen Calculated Property | |
| McVol | 243.900 | ml/mol | McGowan Calculated Property |
| Pc | 1911.91 | kPa | Joback Calculated Property |
| Inp | 2517.00 | NIST | |
| Tboil | 872.34 | K | Joback Calculated Property |
| Tc | 1103.40 | K | Joback Calculated Property |
| Tfus | 567.96 | K | Joback Calculated Property |
| Vc | 0.929 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [601.41; 644.13] | J/mol×K | [872.34; 1103.40] | 
|
| Cp,gas | 601.41 | J/mol×K | 872.34 | Joback Calculated Property |
| Cp,gas | 610.79 | J/mol×K | 910.85 | Joback Calculated Property |
| Cp,gas | 619.25 | J/mol×K | 949.36 | Joback Calculated Property |
| Cp,gas | 626.80 | J/mol×K | 987.87 | Joback Calculated Property |
| Cp,gas | 633.45 | J/mol×K | 1026.38 | Joback Calculated Property |
| Cp,gas | 639.23 | J/mol×K | 1064.89 | Joback Calculated Property |
| Cp,gas | 644.13 | J/mol×K | 1103.40 | Joback Calculated Property |
| η | [0.0000593; 0.0003504] | Pa×s | [567.96; 872.34] |
|
| η | 0.0003504 | Pa×s | 567.96 | Joback Calculated Property |
| η | 0.0002308 | Pa×s | 618.69 | Joback Calculated Property |
| η | 0.0001619 | Pa×s | 669.42 | Joback Calculated Property |
| η | 0.0001194 | Pa×s | 720.15 | Joback Calculated Property |
| η | 0.0000917 | Pa×s | 770.88 | Joback Calculated Property |
| η | 0.0000727 | Pa×s | 821.61 | Joback Calculated Property |
| η | 0.0000593 | Pa×s | 872.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, isobutyl 2,3,4,5-tetrachlorophenyl ester.
Sources
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