- InChI
- InChI=1S/C15H16Cl2O4/c1-9(2)10(3)20-14(18)6-7-15(19)21-13-8-11(16)4-5-12(13)17/h4-10H,1-3H3/b7-6+
- InChI Key
- YBBLTLSRBIQING-VOTSOKGWSA-N
- Formula
- C15H16Cl2O4
- SMILES
-
CC(C)C(C)OC(=O)C=CC(=O)Oc1cc(C
l)ccc1Cl - Molecular Weight1
- 331.19
- 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° | -247.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -553.76 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.85 | kJ/mol | Joback Calculated Property |
| log10WS | -4.67 | Crippen Calculated Property | |
| logPoct/wat | 4.043 | Crippen Calculated Property | |
| McVol | 233.510 | ml/mol | McGowan Calculated Property |
| Pc | 1938.95 | kPa | Joback Calculated Property |
| Inp | [2165.00; 2165.00] |
|
|
| Inp | 2165.00 | NIST | |
| Inp | 2165.00 | NIST | |
| Tboil | 809.96 | K | Joback Calculated Property |
| Tc | 1034.25 | K | Joback Calculated Property |
| Tfus | 479.35 | K | Joback Calculated Property |
| Vc | 0.881 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [618.34; 677.52] | J/mol×K | [809.96; 1034.25] |
|
| Cp,gas | 618.34 | J/mol×K | 809.96 | Joback Calculated Property |
| Cp,gas | 630.62 | J/mol×K | 847.34 | Joback Calculated Property |
| Cp,gas | 641.91 | J/mol×K | 884.72 | Joback Calculated Property |
| Cp,gas | 652.21 | J/mol×K | 922.11 | Joback Calculated Property |
| Cp,gas | 661.57 | J/mol×K | 959.49 | Joback Calculated Property |
| Cp,gas | 670.00 | J/mol×K | 996.87 | Joback Calculated Property |
| Cp,gas | 677.52 | J/mol×K | 1034.25 | Joback Calculated Property |
| η | [0.0000614; 0.0006577] | Pa×s | [479.35; 809.96] |
|
| η | 0.0006577 | Pa×s | 479.35 | Joback Calculated Property |
| η | 0.0003613 | Pa×s | 534.45 | Joback Calculated Property |
| η | 0.0002220 | Pa×s | 589.55 | Joback Calculated Property |
| η | 0.0001483 | Pa×s | 644.65 | Joback Calculated Property |
| η | 0.0001055 | Pa×s | 699.76 | Joback Calculated Property |
| η | 0.0000789 | Pa×s | 754.86 | Joback Calculated Property |
| η | 0.0000614 | Pa×s | 809.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2,5-dichlorophenyl 3-methylbut-2-yl ester.
Sources
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