- InChI
- InChI=1S/C6H7Cl3O2/c7-6(8,9)3-11-5(10)4-1-2-4/h4H,1-3H2
- InChI Key
- KZZRCPHACUAIRF-UHFFFAOYSA-N
- Formula
- C6H7Cl3O2
- SMILES
- O=C(OCC(Cl)(Cl)Cl)C1CC1
- Molecular Weight1
- 217.48
- 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° | -206.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -395.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.88 | kJ/mol | Joback Calculated Property |
| log10WS | -2.41 | Crippen Calculated Property | |
| logPoct/wat | 2.310 | Crippen Calculated Property | |
| McVol | 128.700 | ml/mol | McGowan Calculated Property |
| Pc | 3419.86 | kPa | Joback Calculated Property |
| Inp | [1250.00; 1250.00] |
|
|
| Inp | 1250.00 | NIST | |
| Inp | 1250.00 | NIST | |
| Tboil | 528.77 | K | Joback Calculated Property |
| Tc | 752.92 | K | Joback Calculated Property |
| Tfus | 339.66 | K | Joback Calculated Property |
| Vc | 0.488 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [260.24; 309.42] | J/mol×K | [528.77; 752.92] |
|
| Cp,gas | 260.24 | J/mol×K | 528.77 | Joback Calculated Property |
| Cp,gas | 270.30 | J/mol×K | 566.13 | Joback Calculated Property |
| Cp,gas | 279.53 | J/mol×K | 603.49 | Joback Calculated Property |
| Cp,gas | 287.99 | J/mol×K | 640.85 | Joback Calculated Property |
| Cp,gas | 295.76 | J/mol×K | 678.20 | Joback Calculated Property |
| Cp,gas | 302.88 | J/mol×K | 715.56 | Joback Calculated Property |
| Cp,gas | 309.42 | J/mol×K | 752.92 | Joback Calculated Property |
| η | [0.0005923; 0.0028209] | Pa×s | [339.66; 528.77] |
|
| η | 0.0028209 | Pa×s | 339.66 | Joback Calculated Property |
| η | 0.0019473 | Pa×s | 371.18 | Joback Calculated Property |
| η | 0.0014246 | Pa×s | 402.70 | Joback Calculated Property |
| η | 0.0010906 | Pa×s | 434.22 | Joback Calculated Property |
| η | 0.0008656 | Pa×s | 465.73 | Joback Calculated Property |
| η | 0.0007075 | Pa×s | 497.25 | Joback Calculated Property |
| η | 0.0005923 | Pa×s | 528.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropanecarboxylic acid, 2,2,2-trichloroethyl ester.
Sources
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