![Benzene, [(2-methylpropyl)thio]-](/cid/75-664-2/Benzene-2-methylpropyl-thio.png "Benzene, [(2-methylpropyl)thio]-")
- InChI
- InChI=1S/C10H14S/c1-9(2)8-11-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
- InChI Key
- UQRLAGGSKUVKMJ-UHFFFAOYSA-N
- Formula
- C10H14S
- SMILES
- CC(C)CSc1ccccc1
- Molecular Weight1
- 166.28
- CAS
- 13307-61-4
- Other Names
-
- Sulfide, isobutyl phenyl
- Isobutyl phenyl sulfide
- isobutylthiobenzene
- 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° | 176.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 23.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.56 | kJ/mol | Joback Calculated Property |
| log10WS | -3.23 | Crippen Calculated Property | |
| logPoct/wat | 3.435 | Crippen Calculated Property | |
| McVol | 144.350 | ml/mol | McGowan Calculated Property |
| Pc | 3012.33 | kPa | Joback Calculated Property |
| Inp | 1303.00 | NIST | |
| Tboil | 523.22 | K | Joback Calculated Property |
| Tc | 754.96 | K | Joback Calculated Property |
| Tfus | 248.28 | K | Joback Calculated Property |
| Vc | 0.535 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [310.00; 390.65] | J/mol×K | [523.22; 754.96] | 
|
| Cp,gas | 310.00 | J/mol×K | 523.22 | Joback Calculated Property |
| Cp,gas | 325.83 | J/mol×K | 561.84 | Joback Calculated Property |
| Cp,gas | 340.66 | J/mol×K | 600.47 | Joback Calculated Property |
| Cp,gas | 354.52 | J/mol×K | 639.09 | Joback Calculated Property |
| Cp,gas | 367.45 | J/mol×K | 677.71 | Joback Calculated Property |
| Cp,gas | 379.48 | J/mol×K | 716.34 | Joback Calculated Property |
| Cp,gas | 390.65 | J/mol×K | 754.96 | Joback Calculated Property |
Similar Compounds
![Benzene, [(1-methylpropyl)thio]-.](data:image/png;base64,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)
Find more compounds similar to Benzene, [(2-methylpropyl)thio]-.
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