- InChI
- InChI=1S/C9H4Cl2F6/c10-9(11,17)7(12,13)5-2-1-3-6(4-5)8(14,15)16/h1-4H
- InChI Key
- KUSGUJQWNRFXCL-UHFFFAOYSA-N
- Formula
- C9H4Cl2F6
- SMILES
-
FC(F)(F)c1cccc(C(F)(F)C(F)(Cl)
Cl)c1 - Molecular Weight1
- 297.02
- 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).
- 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° | -1056.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1238.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.55 | kJ/mol | Joback Calculated Property |
| log10WS | -5.01 | Crippen Calculated Property | |
| logPoct/wat | 4.898 | Crippen Calculated Property | |
| McVol | 149.010 | ml/mol | McGowan Calculated Property |
| Pc | 2372.59 | kPa | Joback Calculated Property |
| Inp | [1038.00; 1038.00] |
|
|
| Inp | 1038.00 | NIST | |
| Inp | 1038.00 | NIST | |
| Tboil | 497.77 | K | Joback Calculated Property |
| Tc | 692.71 | K | Joback Calculated Property |
| Tfus | 300.77 | K | Joback Calculated Property |
| Vc | 0.605 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [328.62; 383.43] | J/mol×K | [497.77; 692.71] |
|
| Cp,gas | 328.62 | J/mol×K | 497.77 | Joback Calculated Property |
| Cp,gas | 340.17 | J/mol×K | 530.26 | Joback Calculated Property |
| Cp,gas | 350.66 | J/mol×K | 562.75 | Joback Calculated Property |
| Cp,gas | 360.16 | J/mol×K | 595.24 | Joback Calculated Property |
| Cp,gas | 368.73 | J/mol×K | 627.73 | Joback Calculated Property |
| Cp,gas | 376.47 | J/mol×K | 660.22 | Joback Calculated Property |
| Cp,gas | 383.43 | J/mol×K | 692.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, (2,2-dichloro-1,1,2-trifluoroethyl)-3-(trifluoromethyl).
Sources
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