- InChI
- InChI=1S/C21H36Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-26-20(24)15-16-21(25)27-18-19(22)23/h15-16,19H,2-14,17-18H2,1H3/b16-15+
- InChI Key
- MWXYEQDJMAXBGQ-FOCLMDBBSA-N
- Formula
- C21H36Cl2O4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)C=CC(=O)O
CC(Cl)Cl - Molecular Weight1
- 423.41
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.0947 | Relay (... Calculated Property | |
| ΔfG° | -287.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1031.52 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 60.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 118.94 | kJ/mol | Relay (... Calculated Property |
| IE | 10.34 | eV | Relay (... Calculated Property |
| log10WS | -7.47 | Relay (... Calculated Property | |
| logPoct/wat | 6.524 | Crippen Calculated Property | |
| McVol | 341.810 | ml/mol | McGowan Calculated Property |
| Pc | 1003.98 | kPa | Joback Calculated Property |
| Inp | 2827.00 | NIST | |
| Tboil | 640.67 | K | Relay (... Calculated Property |
| Tc | 834.50 | K | Relay (... Calculated Property |
| Tfus | 326.21 | K | Relay (... Calculated Property |
| Vc | 1.265 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1064.07; 1145.76] | J/mol×K | [911.04; 1115.57] | 
|
| Cp,gas | 1064.07 | J/mol×K | 911.04 | Joback Calculated Property |
| Cp,gas | 1080.38 | J/mol×K | 945.13 | Joback Calculated Property |
| Cp,gas | 1095.56 | J/mol×K | 979.22 | Joback Calculated Property |
| Cp,gas | 1109.64 | J/mol×K | 1013.30 | Joback Calculated Property |
| Cp,gas | 1122.68 | J/mol×K | 1047.39 | Joback Calculated Property |
| Cp,gas | 1134.70 | J/mol×K | 1081.48 | Joback Calculated Property |
| Cp,gas | 1145.76 | J/mol×K | 1115.57 | Joback Calculated Property |
| η | [0.0000264; 0.0004848] | Pa×s | [510.51; 911.04] |
|
| η | 0.0004848 | Pa×s | 510.51 | Joback Calculated Property |
| η | 0.0002254 | Pa×s | 577.26 | Joback Calculated Property |
| η | 0.0001228 | Pa×s | 644.02 | Joback Calculated Property |
| η | 0.0000750 | Pa×s | 710.77 | Joback Calculated Property |
| η | 0.0000499 | Pa×s | 777.53 | Joback Calculated Property |
| η | 0.0000354 | Pa×s | 844.28 | Joback Calculated Property |
| η | 0.0000264 | Pa×s | 911.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2,2-dichloroethyl pentadecyl ester.
Sources
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