- InChI
- InChI=1S/C6H9Cl3O3/c1-4(2)12-5(10)11-3-6(7,8)9/h4H,3H2,1-2H3
- InChI Key
- BXVZTZVGXVIVBP-UHFFFAOYSA-N
- Formula
- C6H9Cl3O3
- SMILES
- CC(C)OC(=O)OCC(Cl)(Cl)Cl
- Molecular Weight1
- 235.49
- 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° | -374.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -605.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.99 | kJ/mol | Joback Calculated Property |
| log10WS | -2.94 | Crippen Calculated Property | |
| logPoct/wat | 2.918 | Crippen Calculated Property | |
| McVol | 145.430 | ml/mol | McGowan Calculated Property |
| Pc | 2925.00 | kPa | Joback Calculated Property |
| Inp | 1206.00 | NIST | |
| Tboil | 544.01 | K | Joback Calculated Property |
| Tc | 754.31 | K | Joback Calculated Property |
| Tfus | 328.95 | K | Joback Calculated Property |
| Vc | 0.543 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [297.45; 346.97] | J/mol×K | [544.01; 754.31] | 
|
| Cp,gas | 297.45 | J/mol×K | 544.01 | Joback Calculated Property |
| Cp,gas | 307.07 | J/mol×K | 579.06 | Joback Calculated Property |
| Cp,gas | 316.13 | J/mol×K | 614.11 | Joback Calculated Property |
| Cp,gas | 324.64 | J/mol×K | 649.16 | Joback Calculated Property |
| Cp,gas | 332.61 | J/mol×K | 684.21 | Joback Calculated Property |
| Cp,gas | 340.05 | J/mol×K | 719.26 | Joback Calculated Property |
| Cp,gas | 346.97 | J/mol×K | 754.31 | Joback Calculated Property |
| η | [0.0002075; 0.0027759] | Pa×s | [328.95; 544.01] |
|
| η | 0.0027759 | Pa×s | 328.95 | Joback Calculated Property |
| η | 0.0014570 | Pa×s | 364.79 | Joback Calculated Property |
| η | 0.0008582 | Pa×s | 400.64 | Joback Calculated Property |
| η | 0.0005514 | Pa×s | 436.48 | Joback Calculated Property |
| η | 0.0003789 | Pa×s | 472.32 | Joback Calculated Property |
| η | 0.0002745 | Pa×s | 508.17 | Joback Calculated Property |
| η | 0.0002075 | Pa×s | 544.01 | Joback Calculated Property |
Similar Compounds
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