- InChI
- InChI=1S/C8H2Cl3F3O2/c9-3-1-4(10)6(11)5(2-3)16-7(15)8(12,13)14/h1-2H
- InChI Key
- VRHGAJDZCAFIGN-UHFFFAOYSA-N
- Formula
- C8H2Cl3F3O2
- SMILES
-
O=C(Oc1cc(Cl)cc(Cl)c1Cl)C(F)(F
)F - Molecular Weight1
- 293.45
- 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° | -751.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -895.43 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.23 | kJ/mol | Joback Calculated Property |
| log10WS | -4.50 | Crippen Calculated Property | |
| logPoct/wat | 4.115 | Crippen Calculated Property | |
| McVol | 149.290 | ml/mol | McGowan Calculated Property |
| Pc | 2826.33 | kPa | Joback Calculated Property |
| Inp | [1264.00; 1264.00] |
|
|
| Inp | 1264.00 | NIST | |
| Inp | 1264.00 | NIST | |
| Tboil | 607.22 | K | Joback Calculated Property |
| Tc | 823.97 | K | Joback Calculated Property |
| Tfus | 410.01 | K | Joback Calculated Property |
| Vc | 0.590 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [306.46; 342.68] | J/mol×K | [607.22; 823.97] |
|
| Cp,gas | 306.46 | J/mol×K | 607.22 | Joback Calculated Property |
| Cp,gas | 313.90 | J/mol×K | 643.35 | Joback Calculated Property |
| Cp,gas | 320.74 | J/mol×K | 679.47 | Joback Calculated Property |
| Cp,gas | 327.02 | J/mol×K | 715.60 | Joback Calculated Property |
| Cp,gas | 332.75 | J/mol×K | 751.72 | Joback Calculated Property |
| Cp,gas | 337.96 | J/mol×K | 787.85 | Joback Calculated Property |
| Cp,gas | 342.68 | J/mol×K | 823.97 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,5-Trichlorophenol, O-trifluoroacetyl-.
Sources
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