- InChI
- InChI=1S/C16H25Cl3O4/c1-2-3-4-5-6-7-8-9-12-22-14(20)10-11-15(21)23-13-16(17,18)19/h10-11H,2-9,12-13H2,1H3/b11-10+
- InChI Key
- KZHVAYZESXTNDB-ZHACJKMWSA-N
- Formula
- C16H25Cl3O4
- SMILES
-
CCCCCCCCCCOC(=O)C=CC(=O)OCC(Cl
)(Cl)Cl - Molecular Weight1
- 387.73
- 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 | 0.8865 | Relay (... Calculated Property | |
| ΔfG° | -336.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -932.55 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 48.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.15 | kJ/mol | Relay (... Calculated Property |
| IE | 10.40 | eV | Relay (... Calculated Property |
| log10WS | -6.83 | Relay (... Calculated Property | |
| logPoct/wat | 5.140 | Crippen Calculated Property | |
| McVol | 283.600 | ml/mol | McGowan Calculated Property |
| Pc | 1369.71 | kPa | Joback Calculated Property |
| Inp | 2380.00 | NIST | |
| Tboil | 608.35 | K | Relay (... Calculated Property |
| Tc | 801.40 | K | Relay (... Calculated Property |
| Tfus | 333.12 | K | Relay (... Calculated Property |
| Vc | 1.032 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [796.28; 864.55] | J/mol×K | [831.28; 1031.86] | 
|
| Cp,gas | 796.28 | J/mol×K | 831.28 | Joback Calculated Property |
| Cp,gas | 809.70 | J/mol×K | 864.71 | Joback Calculated Property |
| Cp,gas | 822.24 | J/mol×K | 898.14 | Joback Calculated Property |
| Cp,gas | 833.95 | J/mol×K | 931.57 | Joback Calculated Property |
| Cp,gas | 844.87 | J/mol×K | 965.00 | Joback Calculated Property |
| Cp,gas | 855.06 | J/mol×K | 998.43 | Joback Calculated Property |
| Cp,gas | 864.55 | J/mol×K | 1031.86 | Joback Calculated Property |
| η | [0.0000415; 0.0005571] | Pa×s | [501.50; 831.28] |
|
| η | 0.0005571 | Pa×s | 501.50 | Joback Calculated Property |
| η | 0.0002918 | Pa×s | 556.46 | Joback Calculated Property |
| η | 0.0001716 | Pa×s | 611.43 | Joback Calculated Property |
| η | 0.0001102 | Pa×s | 666.39 | Joback Calculated Property |
| η | 0.0000757 | Pa×s | 721.35 | Joback Calculated Property |
| η | 0.0000548 | Pa×s | 776.32 | Joback Calculated Property |
| η | 0.0000415 | Pa×s | 831.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, decyl 2,2,2-trichloroethyl ester.
Sources
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