- InChI
- InChI=1S/C8H10S2/c1-9-10-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
- InChI Key
- NWYGPVZOBBHKLI-UHFFFAOYSA-N
- Formula
- C8H10S2
- SMILES
- CSSCc1ccccc1
- Molecular Weight1
- 170.29
- CAS
- 699-10-5
- Other Names
-
- Disulfide, methyl phenylmethyl
- Disulfide, benzyl methyl
- Methyl benzyl disulfide
- benzyl methyl disulphide
- 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° | 195.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 111.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.31 | kJ/mol | Joback Calculated Property |
| log10WS | -3.53 | Crippen Calculated Property | |
| logPoct/wat | 3.198 | Crippen Calculated Property | |
| McVol | 132.520 | ml/mol | McGowan Calculated Property |
| Pc | 3805.69 | kPa | Joback Calculated Property |
| Inp | 1417.00 | NIST | |
| Tboil | 546.68 | K | Joback Calculated Property |
| Tc | 804.40 | K | Joback Calculated Property |
| Tfus | 275.14 | K | Joback Calculated Property |
| Vc | 0.483 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [269.83; 336.73] | J/mol×K | [546.68; 804.40] | 
|
| Cp,gas | 269.83 | J/mol×K | 546.68 | Joback Calculated Property |
| Cp,gas | 283.35 | J/mol×K | 589.63 | Joback Calculated Property |
| Cp,gas | 295.89 | J/mol×K | 632.59 | Joback Calculated Property |
| Cp,gas | 307.47 | J/mol×K | 675.54 | Joback Calculated Property |
| Cp,gas | 318.12 | J/mol×K | 718.49 | Joback Calculated Property |
| Cp,gas | 327.87 | J/mol×K | 761.45 | Joback Calculated Property |
| Cp,gas | 336.73 | J/mol×K | 804.40 | Joback Calculated Property |
Similar Compounds
![Benzene, [(methylsulfinyl)methyl]-.](data:image/png;base64,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)
Find more compounds similar to Benzyl methyl disulfide.
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