- InChI
- InChI=1S/C7HF7/c8-2-1-3(9)6(11)4(5(2)10)7(12,13)14/h1H
- InChI Key
- ZVPAJILXQHMKMT-UHFFFAOYSA-N
- Formula
- C7HF7
- SMILES
- Fc1cc(F)c(F)c(C(F)(F)F)c1F
- Molecular Weight1
- 218.07
- CAS
- 651-80-9
- Other Names
-
- Toluene, «alpha»,«alpha»,«alpha»,2,3,5,6-heptafluoro-
- 1-(Trifluoromethyl)-2,3,5,6-tetrafluorobenzene
- 4H-Heptafluorotoluene
- «alpha»,«alpha»,«alpha»,2,3,5,6-Heptafluoro-toluene
- 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).
- 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° | -1278.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1378.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 29.09 | kJ/mol | Joback Calculated Property |
| log10WS | -3.90 | Crippen Calculated Property | |
| logPoct/wat | 3.262 | Crippen Calculated Property | |
| McVol | 98.120 | ml/mol | McGowan Calculated Property |
| Pc | 2726.86 | kPa | Joback Calculated Property |
| Tboil | 384.70 | K | NIST |
| Tc | 556.06 | K | Joback Calculated Property |
| Tfus | 251.70 | K | Joback Calculated Property |
| Vc | 0.434 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [203.39; 242.56] | J/mol×K | [397.82; 556.06] | 
|
| Cp,gas | 203.39 | J/mol×K | 397.82 | Joback Calculated Property |
| Cp,gas | 210.81 | J/mol×K | 424.19 | Joback Calculated Property |
| Cp,gas | 217.86 | J/mol×K | 450.57 | Joback Calculated Property |
| Cp,gas | 224.55 | J/mol×K | 476.94 | Joback Calculated Property |
| Cp,gas | 230.88 | J/mol×K | 503.31 | Joback Calculated Property |
| Cp,gas | 236.89 | J/mol×K | 529.69 | Joback Calculated Property |
| Cp,gas | 242.56 | J/mol×K | 556.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1,2,4,5-tetrafluoro-3-(trifluoromethyl)-.
Sources
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