- InChI
- InChI=1S/C8H5Cl2F3/c9-7(10,8(11,12)13)6-4-2-1-3-5-6/h1-5H
- InChI Key
- VCGJIIDFWDVVQE-UHFFFAOYSA-N
- Formula
- C8H5Cl2F3
- SMILES
- FC(F)(F)C(Cl)(Cl)c1ccccc1
- Molecular Weight1
- 229.03
- CAS
- 309-10-4
- Other Names
-
- 1,1,1-Trifluoro-2,2-dichloro-2-phenylethane
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- 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° | -473.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -609.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.41 | kJ/mol | Joback Calculated Property |
| log10WS | -3.91 | Crippen Calculated Property | |
| logPoct/wat | 3.879 | Crippen Calculated Property | |
| McVol | 129.610 | ml/mol | McGowan Calculated Property |
| Pc | 2999.15 | kPa | Joback Calculated Property |
| Tboil | 363.00 ± 4.00 | K | NIST |
| Tc | 691.32 | K | Joback Calculated Property |
| Tfus | 272.79 | K | Joback Calculated Property |
| Vc | 0.505 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [258.23; 314.55] | J/mol×K | [475.33; 691.32] | 
|
| Cp,gas | 258.23 | J/mol×K | 475.33 | Joback Calculated Property |
| Cp,gas | 270.16 | J/mol×K | 511.33 | Joback Calculated Property |
| Cp,gas | 280.97 | J/mol×K | 547.33 | Joback Calculated Property |
| Cp,gas | 290.73 | J/mol×K | 583.33 | Joback Calculated Property |
| Cp,gas | 299.52 | J/mol×K | 619.33 | Joback Calculated Property |
| Cp,gas | 307.44 | J/mol×K | 655.32 | Joback Calculated Property |
| Cp,gas | 314.55 | J/mol×K | 691.32 | Joback Calculated Property |
| ΔvapH | 47.20 | kJ/mol | 405.50 | NIST |
Similar Compounds
Find more compounds similar to 1,1-dichloro-2,2,2-trifluoro-1-phenylethane.
Sources
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