- InChI
- InChI=1S/C6H6F4OS/c1-3(12)2-4(11)6(9,10)5(7)8/h2,5,11H,1H3/b4-2-
- InChI Key
- GJTXQUBCEARLFL-RQOWECAXSA-N
- Formula
- C6H6F4OS
- SMILES
- CC(=S)C=C(O)C(F)(F)C(F)F
- Molecular Weight1
- 202.17
- CAS
- 88551-98-8
- 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° | -727.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -863.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.44 | kJ/mol | Joback Calculated Property |
| log10WS | -2.99 | Crippen Calculated Property | |
| logPoct/wat | 2.719 | Crippen Calculated Property | |
| McVol | 116.100 | ml/mol | McGowan Calculated Property |
| Pc | 3435.91 | kPa | Joback Calculated Property |
| Tboil | 496.35 | K | Joback Calculated Property |
| Tc | 671.48 | K | Joback Calculated Property |
| Tfus | 223.21 | K | Joback Calculated Property |
| Vc | 0.463 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [257.60; 297.18] | J/mol×K | [496.35; 671.48] | 
|
| Cp,gas | 257.60 | J/mol×K | 496.35 | Joback Calculated Property |
| Cp,gas | 265.60 | J/mol×K | 525.54 | Joback Calculated Property |
| Cp,gas | 272.98 | J/mol×K | 554.73 | Joback Calculated Property |
| Cp,gas | 279.78 | J/mol×K | 583.91 | Joback Calculated Property |
| Cp,gas | 286.04 | J/mol×K | 613.10 | Joback Calculated Property |
| Cp,gas | 291.83 | J/mol×K | 642.29 | Joback Calculated Property |
| Cp,gas | 297.18 | J/mol×K | 671.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Hexene-2-thione,5,5,6,6-tetrafluoro-4-hydroxy-.
Sources
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