- InChI
- InChI=1S/C9H12Cl4O3/c1-3-8(4-2,6(10)14)7(15)16-5-9(11,12)13/h3-5H2,1-2H3
- InChI Key
- OSZPCPWIAWYGCF-UHFFFAOYSA-N
- Formula
- C9H12Cl4O3
- SMILES
-
CCC(CC)(C(=O)Cl)C(=O)OCC(Cl)(C
l)Cl - Molecular Weight1
- 310.00
- 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° | -379.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -666.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.48 | kJ/mol | Joback Calculated Property |
| log10WS | -3.70 | Crippen Calculated Property | |
| logPoct/wat | 3.472 | Crippen Calculated Property | |
| McVol | 195.640 | ml/mol | McGowan Calculated Property |
| Pc | 2304.74 | kPa | Joback Calculated Property |
| Inp | [1531.00; 1531.00] |
|
|
| Inp | 1531.00 | NIST | |
| Inp | 1531.00 | NIST | |
| Tboil | 678.74 | K | Joback Calculated Property |
| Tc | 899.46 | K | Joback Calculated Property |
| Tfus | 437.80 | K | Joback Calculated Property |
| Vc | 0.744 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [450.11; 500.39] | J/mol×K | [678.74; 899.46] |
|
| Cp,gas | 450.11 | J/mol×K | 678.74 | Joback Calculated Property |
| Cp,gas | 460.37 | J/mol×K | 715.53 | Joback Calculated Property |
| Cp,gas | 469.79 | J/mol×K | 752.31 | Joback Calculated Property |
| Cp,gas | 478.45 | J/mol×K | 789.10 | Joback Calculated Property |
| Cp,gas | 486.39 | J/mol×K | 825.89 | Joback Calculated Property |
| Cp,gas | 493.69 | J/mol×K | 862.68 | Joback Calculated Property |
| Cp,gas | 500.39 | J/mol×K | 899.46 | Joback Calculated Property |
| η | [0.0001366; 0.0014796] | Pa×s | [437.80; 678.74] |
|
| η | 0.0014796 | Pa×s | 437.80 | Joback Calculated Property |
| η | 0.0008418 | Pa×s | 477.96 | Joback Calculated Property |
| η | 0.0005227 | Pa×s | 518.11 | Joback Calculated Property |
| η | 0.0003476 | Pa×s | 558.27 | Joback Calculated Property |
| η | 0.0002442 | Pa×s | 598.43 | Joback Calculated Property |
| η | 0.0001793 | Pa×s | 638.58 | Joback Calculated Property |
| η | 0.0001366 | Pa×s | 678.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, monochloride, 2,2,2-trichloroethyl ester.
Sources
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