- InChI
- InChI=1S/C17H20Cl2O4/c1-3-4-5-6-12(2)22-16(20)9-10-17(21)23-15-8-7-13(18)11-14(15)19/h7-12H,3-6H2,1-2H3/b10-9+
- InChI Key
- JYGJSCUSGPQLPQ-MDZDMXLPSA-N
- Formula
- C17H20Cl2O4
- SMILES
-
CCCCCC(C)OC(=O)C=CC(=O)Oc1ccc(
Cl)cc1Cl - Molecular Weight1
- 359.24
- 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° | -228.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -589.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.69 | kJ/mol | Joback Calculated Property |
| log10WS | -5.75 | Crippen Calculated Property | |
| logPoct/wat | 4.967 | Crippen Calculated Property | |
| McVol | 261.690 | ml/mol | McGowan Calculated Property |
| Pc | 1637.78 | kPa | Joback Calculated Property |
| Inp | [2385.00; 2385.00] |
|
|
| Inp | 2385.00 | NIST | |
| Inp | 2385.00 | NIST | |
| Tboil | 856.16 | K | Joback Calculated Property |
| Tc | 1073.35 | K | Joback Calculated Property |
| Tfus | 516.89 | K | Joback Calculated Property |
| Vc | 1.000 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [728.69; 790.29] | J/mol×K | [856.16; 1073.35] |
|
| Cp,gas | 728.69 | J/mol×K | 856.16 | Joback Calculated Property |
| Cp,gas | 741.40 | J/mol×K | 892.36 | Joback Calculated Property |
| Cp,gas | 753.09 | J/mol×K | 928.56 | Joback Calculated Property |
| Cp,gas | 763.80 | J/mol×K | 964.76 | Joback Calculated Property |
| Cp,gas | 773.55 | J/mol×K | 1000.95 | Joback Calculated Property |
| Cp,gas | 782.37 | J/mol×K | 1037.15 | Joback Calculated Property |
| Cp,gas | 790.29 | J/mol×K | 1073.35 | Joback Calculated Property |
| η | [0.0000507; 0.0004807] | Pa×s | [516.89; 856.16] |
|
| η | 0.0004807 | Pa×s | 516.89 | Joback Calculated Property |
| η | 0.0002746 | Pa×s | 573.43 | Joback Calculated Property |
| η | 0.0001735 | Pa×s | 629.98 | Joback Calculated Property |
| η | 0.0001182 | Pa×s | 686.52 | Joback Calculated Property |
| η | 0.0000854 | Pa×s | 743.07 | Joback Calculated Property |
| η | 0.0000646 | Pa×s | 799.61 | Joback Calculated Property |
| η | 0.0000507 | Pa×s | 856.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2,4-dichlorophenyl hept-2-yl ester.
Sources
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