![2,2'-Thiobis[4-fluorophenol]](/cid/61-772-7/2-2-Thiobis-4-fluorophenol.png "2,2'-Thiobis[4-fluorophenol]")
- InChI
- InChI=1S/C12H8F2O2S/c13-7-1-3-9(15)11(5-7)17-12-6-8(14)2-4-10(12)16/h1-6,15-16H
- InChI Key
- QAEAOHFXMHQPCG-UHFFFAOYSA-N
- Formula
- C12H8F2O2S
- SMILES
- Oc1ccc(F)cc1Sc1cc(F)ccc1O
- Molecular Weight1
- 254.25
- CAS
- 401-14-9
- 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° | -410.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -545.86 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.39 | kJ/mol | Joback Calculated Property |
| log10WS | -3.65 | Crippen Calculated Property | |
| logPoct/wat | 3.527 | Crippen Calculated Property | |
| McVol | 164.050 | ml/mol | McGowan Calculated Property |
| Pc | 4368.40 | kPa | Joback Calculated Property |
| Tboil | 765.84 | K | Joback Calculated Property |
| Tc | 1026.09 | K | Joback Calculated Property |
| Tfus | 561.90 | K | Joback Calculated Property |
| Vc | 0.513 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [429.87; 486.58] | J/mol×K | [765.84; 1026.09] | 
|
| Cp,gas | 429.87 | J/mol×K | 765.84 | Joback Calculated Property |
| Cp,gas | 439.96 | J/mol×K | 809.21 | Joback Calculated Property |
| Cp,gas | 449.54 | J/mol×K | 852.59 | Joback Calculated Property |
| Cp,gas | 458.81 | J/mol×K | 895.96 | Joback Calculated Property |
| Cp,gas | 467.94 | J/mol×K | 939.34 | Joback Calculated Property |
| Cp,gas | 477.14 | J/mol×K | 982.71 | Joback Calculated Property |
| Cp,gas | 486.58 | J/mol×K | 1026.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2'-Thiobis[4-fluorophenol].
Sources
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