3-(Methylsulfanyl)propanenitrile
3-methylsulfanylpropanenitrile
Also Known As: 3-(methylthio)propanenitrile|Propanenitrile, 3-(methylthio)-|3-(Methylsulfanyl)propanenitrile|3- propanenitrile|3-methylsulfanylpropanenitrile|3-methylthiopropanenitrile|3-(methylthio)-propionitrile|Propanenitrile,3-(methylthio)|3-(Methylsulfanyl)propanenitrile #|3-METHYLMERCAPTOPROPIONITRILE|5452AE|887-563-3
CAS: 54974-63-9
| Molecular Formula | C4H7NS |
|---|---|
| Molecular Weight | 101.02992 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 101.02992 |
| Monoisotopic Mass | 101.02992 |
| Heavy Atoms | 6 |
| Complexity | 61.0 |
Chemical Identifiers
| CAS Number | 54974-63-9 |
|---|---|
| SMILES | CSCCC#N |
| InChIKey | INDWVHABTMSBCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Biotechnology (15 patents)
Heterocyclic Building Blocks (23 patents)
Organic Building Blocks (17 patents)
Pharmaceutical Intermediates (9 patents)
Product Overview
3-(Methylsulfanyl)propanenitrile (CAS 54974-63-9), with molecular formula C4H7NS and molecular weight 101.02992 g/mol. IUPAC: 3-methylsulfanylpropanenitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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