- InChI
- InChI=1S/C11H14Cl6O4/c1-3-9(4-2,7(18)20-5-10(12,13)14)8(19)21-6-11(15,16)17/h3-6H2,1-2H3
- InChI Key
- OAAFLQBHJGZGIM-UHFFFAOYSA-N
- Formula
- C11H14Cl6O4
- SMILES
-
CCC(CC)(C(=O)OCC(Cl)(Cl)Cl)C(=
O)OCC(Cl)(Cl)Cl - Molecular Weight1
- 422.94
- 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 | 0.6477 | Relay (... Calculated Property | |
| ΔfG° | -489.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -980.20 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 32.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.88 | kJ/mol | Relay (... Calculated Property |
| IE | 10.47 | eV | Relay (... Calculated Property |
| log10WS | -5.95 | Relay (... Calculated Property | |
| logPoct/wat | 4.620 | Crippen Calculated Property | |
| McVol | 254.170 | ml/mol | McGowan Calculated Property |
| Pc | 1815.41 | kPa | Joback Calculated Property |
| Inp | 1976.00 | NIST | |
| Tboil | 580.64 | K | Relay (... Calculated Property |
| Tc | 820.12 | K | Relay (... Calculated Property |
| Tfus | 396.53 | K | Relay (... Calculated Property |
| Vc | 0.882 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [619.08; 663.17] | J/mol×K | [818.55; 1046.46] | 
|
| Cp,gas | 619.08 | J/mol×K | 818.55 | Joback Calculated Property |
| Cp,gas | 628.17 | J/mol×K | 856.53 | Joback Calculated Property |
| Cp,gas | 636.44 | J/mol×K | 894.52 | Joback Calculated Property |
| Cp,gas | 643.99 | J/mol×K | 932.50 | Joback Calculated Property |
| Cp,gas | 650.91 | J/mol×K | 970.49 | Joback Calculated Property |
| Cp,gas | 657.27 | J/mol×K | 1008.47 | Joback Calculated Property |
| Cp,gas | 663.17 | J/mol×K | 1046.46 | Joback Calculated Property |
| η | [0.0000394; 0.0004139] | Pa×s | [544.83; 818.55] |
|
| η | 0.0004139 | Pa×s | 544.83 | Joback Calculated Property |
| η | 0.0002404 | Pa×s | 590.45 | Joback Calculated Property |
| η | 0.0001509 | Pa×s | 636.07 | Joback Calculated Property |
| η | 0.0001008 | Pa×s | 681.69 | Joback Calculated Property |
| η | 0.0000709 | Pa×s | 727.31 | Joback Calculated Property |
| η | 0.0000519 | Pa×s | 772.93 | Joback Calculated Property |
| η | 0.0000394 | Pa×s | 818.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, di(2,2,2-trichloroethyl) ester.
Sources
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