- InChI
- InChI=1S/C7H11Cl3O2/c1-4(2)5(3)12-6(11)7(8,9)10/h4-5H,1-3H3
- InChI Key
- DLGMINPBZKHLST-UHFFFAOYSA-N
- Formula
- C7H11Cl3O2
- SMILES
- CC(C)C(C)OC(=O)C(Cl)(Cl)Cl
- Molecular Weight1
- 233.52
- 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.
- I : 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° | -263.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -499.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.41 | kJ/mol | Joback Calculated Property |
| log10WS | -3.05 | Crippen Calculated Property | |
| logPoct/wat | 2.944 | Crippen Calculated Property | |
| McVol | 153.650 | ml/mol | McGowan Calculated Property |
| Pc | 2712.67 | kPa | Joback Calculated Property |
| Inp | [1163.00; 1163.00] |
|
|
| Inp | 1163.00 | NIST | |
| Inp | 1163.00 | NIST | |
| I | [1446.00; 1446.00] |
|
|
| I | 1446.00 | NIST | |
| I | 1446.00 | NIST | |
| Tboil | 544.03 | K | Joback Calculated Property |
| Tc | 757.75 | K | Joback Calculated Property |
| Tfus | 302.99 | K | Joback Calculated Property |
| Vc | 0.576 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [319.41; 375.88] | J/mol×K | [544.03; 757.75] |
|
| Cp,gas | 319.41 | J/mol×K | 544.03 | Joback Calculated Property |
| Cp,gas | 330.51 | J/mol×K | 579.65 | Joback Calculated Property |
| Cp,gas | 340.90 | J/mol×K | 615.27 | Joback Calculated Property |
| Cp,gas | 350.61 | J/mol×K | 650.89 | Joback Calculated Property |
| Cp,gas | 359.65 | J/mol×K | 686.51 | Joback Calculated Property |
| Cp,gas | 368.07 | J/mol×K | 722.13 | Joback Calculated Property |
| Cp,gas | 375.88 | J/mol×K | 757.75 | Joback Calculated Property |
| η | [0.0002209; 0.0052610] | Pa×s | [302.99; 544.03] |
|
| η | 0.0052610 | Pa×s | 302.99 | Joback Calculated Property |
| η | 0.0022766 | Pa×s | 343.16 | Joback Calculated Property |
| η | 0.0011742 | Pa×s | 383.34 | Joback Calculated Property |
| η | 0.0006867 | Pa×s | 423.51 | Joback Calculated Property |
| η | 0.0004407 | Pa×s | 463.68 | Joback Calculated Property |
| η | 0.0003036 | Pa×s | 503.86 | Joback Calculated Property |
| η | 0.0002209 | Pa×s | 544.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Acetic acid, trichloro, 1,2-dimethylpropyl ester.
Sources
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