Butanenitrile, 3-methyl-2-(phenylthio)-
3-methyl-2-phenylsulfanylbutanenitrile
Also Known As: Butanenitrile, 3-methyl-2-(phenylthio)-|ACMC-20lkb9|3-methyl-2-(phenylsulfanyl)butanenitrile|3-methyl-2-phenylsulfanylbutanenitrile|1-nitro-2-cyanomethyl-naphthalene|3-methyl-2-phenylsulfanyl-butanenitrile
CAS: 89278-07-9
| Molecular Formula | C11H13NS |
|---|---|
| Molecular Weight | 191.07687 g/mol |
| LogP | 3.32688 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.07687 |
| Monoisotopic Mass | 191.07687 |
| Heavy Atoms | 13 |
| Complexity | 286.70862 |
Chemical Identifiers
| CAS Number | 89278-07-9 |
|---|---|
| SMILES | CC(C)C(C#N)SC1=CC=CC=C1 |
Product Overview
Butanenitrile, 3-methyl-2-(phenylthio)- (CAS 89278-07-9), with molecular formula C11H13NS and molecular weight 191.07687 g/mol. IUPAC: 3-methyl-2-phenylsulfanylbutanenitrile.
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.
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