3-(Benzylsulfanyl)propanenitrile
3-benzylsulfanylpropanenitrile
Also Known As: 3-(benzylsulfanyl)propanenitrile|3-benzylsulfanylpropanenitrile|3-benzylthiopropanitrile|3-BENZYLTHIOPROPIONITRILE|3-(Benzylthio)propanenitrile|3-(Benzylthio)-propionitrile|beta-Benzylmercaptopropionitrile|3-(BENZYLTHIO)PROPIONITRILE|3-[(phenylmethyl)thio]Propanenitrile|3-Benzylmercapto-propionsaeure-nitril|3-(phenylmethylsulfanyl)propanenitrile|Propanenitrile,3-[(phenylmethyl)thio]-|Propanenitrile, 3-[(phenylmethyl)thio]-|J2.701.066K|3-(3-m-Tolyl-[1,2,4]oxadiazol-5-yl)-propionic acid
| Molecular Formula | C10H11NS |
|---|---|
| Molecular Weight | 177.06122 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 177.06122 |
| Monoisotopic Mass | 177.06122 |
| Heavy Atoms | 12 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 63429-99-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSCCC#N |
| InChIKey | UUQUDAQRNLCILI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Benzylsulfanyl)propanenitrile (CAS 63429-99-2), with molecular formula C10H11NS and molecular weight 177.06122 g/mol. IUPAC: 3-benzylsulfanylpropanenitrile.
3-(Benzylsulfanyl)propanenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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