- InChI
- InChI=1S/CH3S/c1-2/h2H,1H2
- InChI Key
- YYOGAOHWUDJBLM-UHFFFAOYSA-N
- Formula
- CH3S
- SMILES
- [CH2]S
- Molecular Weight1
- 47.10
- CAS
- 17032-46-1
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- EA : Electron affinity (eV).
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| PAff | 733.90 | kJ/mol | NIST |
| BasG | 701.50 | kJ/mol | NIST |
| EA | 0.78 ± 0.33 | eV | NIST |
| ΔfG° | 39.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 30.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 4.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 24.41 | kJ/mol | Joback Calculated Property |
| IE | 7.54 ± 0.00 | eV | NIST |
| log10WS | -0.42 | Crippen Calculated Property | |
| logPoct/wat | 0.708 | Crippen Calculated Property | |
| McVol | 39.150 | ml/mol | McGowan Calculated Property |
| Pc | 6875.52 | kPa | Joback Calculated Property |
| Tboil | 284.44 | K | Joback Calculated Property |
| Tc | 470.35 | K | Joback Calculated Property |
| Tfus | 153.86 | K | Joback Calculated Property |
| Vc | 0.137 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [43.23; 58.61] | J/mol×K | [284.44; 470.35] | 
|
| Cp,gas | 43.23 | J/mol×K | 284.44 | Joback Calculated Property |
| Cp,gas | 46.45 | J/mol×K | 315.42 | Joback Calculated Property |
| Cp,gas | 49.39 | J/mol×K | 346.41 | Joback Calculated Property |
| Cp,gas | 52.05 | J/mol×K | 377.39 | Joback Calculated Property |
| Cp,gas | 54.46 | J/mol×K | 408.38 | Joback Calculated Property |
| Cp,gas | 56.64 | J/mol×K | 439.36 | Joback Calculated Property |
| Cp,gas | 58.61 | J/mol×K | 470.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Mercaptomethyl radical.
Sources
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