- InChI
- InChI=1S/C7H4Cl3F/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4H
- InChI Key
- JRTYPYSADXRJBQ-UHFFFAOYSA-N
- Formula
- C7H4Cl3F
- SMILES
- Fc1cccc(C(Cl)(Cl)Cl)c1
- Molecular Weight1
- 213.46
- CAS
- 401-77-4
- Other Names
-
- m-fluoro-«alpha»,«alpha»,«alpha»-trichlorotoluene
- 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° | -116.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -214.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.16 | kJ/mol | Joback Calculated Property |
| log10WS | -3.81 | Crippen Calculated Property | |
| logPoct/wat | 3.652 | Crippen Calculated Property | |
| McVol | 124.220 | ml/mol | McGowan Calculated Property |
| Pc | 3415.86 | kPa | Joback Calculated Property |
| Inp | [1168.00; 1168.00] |
|
|
| Inp | 1168.00 | NIST | |
| Inp | 1168.00 | NIST | |
| Inp | 1168.00 | NIST | |
| Tboil | 499.55 | K | Joback Calculated Property |
| Tc | 736.18 | K | Joback Calculated Property |
| Tfus | 300.36 | K | Joback Calculated Property |
| Vc | 0.473 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [220.81; 265.47] | J/mol×K | [499.55; 736.18] |
|
| Cp,gas | 220.81 | J/mol×K | 499.55 | Joback Calculated Property |
| Cp,gas | 230.24 | J/mol×K | 538.99 | Joback Calculated Property |
| Cp,gas | 238.80 | J/mol×K | 578.43 | Joback Calculated Property |
| Cp,gas | 246.53 | J/mol×K | 617.86 | Joback Calculated Property |
| Cp,gas | 253.51 | J/mol×K | 657.30 | Joback Calculated Property |
| Cp,gas | 259.80 | J/mol×K | 696.74 | Joback Calculated Property |
| Cp,gas | 265.47 | J/mol×K | 736.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-fluoro-3-trichloromethyl.
Sources
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