- InChI
- InChI=1S/C3H7NOS/c1-4-3(5)2-6/h6H,2H2,1H3,(H,4,5)
- InChI Key
- NSJNRJYQQPRCLF-UHFFFAOYSA-N
- Formula
- C3H7NOS
- SMILES
- CNC(=O)CS
- Molecular Weight1
- 105.16
- CAS
- 20938-74-3
- 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° | -35.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -125.88 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.19 | kJ/mol | Joback Calculated Property |
| log10WS | -0.12 | Crippen Calculated Property | |
| logPoct/wat | -0.338 | Crippen Calculated Property | |
| McVol | 81.030 | ml/mol | McGowan Calculated Property |
| Pc | 5359.18 | kPa | Joback Calculated Property |
| Inp | [938.00; 938.00] |
|
|
| Inp | 938.00 | NIST | |
| Inp | 938.00 | NIST | |
| Tboil | 434.94 | K | Joback Calculated Property |
| Tc | 646.04 | K | Joback Calculated Property |
| Tfus | 262.62 | K | Joback Calculated Property |
| Vc | 0.298 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [145.99; 185.07] | J/mol×K | [434.94; 646.04] |
|
| Cp,gas | 145.99 | J/mol×K | 434.94 | Joback Calculated Property |
| Cp,gas | 153.39 | J/mol×K | 470.12 | Joback Calculated Property |
| Cp,gas | 160.42 | J/mol×K | 505.31 | Joback Calculated Property |
| Cp,gas | 167.09 | J/mol×K | 540.49 | Joback Calculated Property |
| Cp,gas | 173.42 | J/mol×K | 575.67 | Joback Calculated Property |
| Cp,gas | 179.41 | J/mol×K | 610.86 | Joback Calculated Property |
| Cp,gas | 185.07 | J/mol×K | 646.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-(methyl)mercaptoacetamide.
Sources
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