- InChI
- InChI=1S/C3H7NOS/c4-3(5)1-2-6/h6H,1-2H2,(H2,4,5)
- InChI Key
- JLSJEUQOXVVCPN-UHFFFAOYSA-N
- Formula
- C3H7NOS
- SMILES
- N=C(O)CCS
- Molecular Weight1
- 105.16
- CAS
- 763-35-9
- 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).
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 70.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -20.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.77 | kJ/mol | Joback Calculated Property |
| log10WS | -1.88 | Crippen Calculated Property | |
| logPoct/wat | 0.842 | Crippen Calculated Property | |
| McVol | 81.030 | ml/mol | McGowan Calculated Property |
| Tboil | 507.42 | K | Joback Calculated Property |
| Tfus | 289.63 | K | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [41.72; 161.56] | J/mol×K | [100.12; 507.42] | 
|
| Cp,gas | 41.72 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 41.72 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 41.72 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 41.72 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 41.72 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 41.72 | J/mol×K | 100.12 | Joback Calculated Property |
| Cp,gas | 161.56 | J/mol×K | 507.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Belta-mercaptopropionamide.
Sources
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