4-(Trifluoromethylthio)phenylacetonitrile
2-[4-(trifluoromethylsulfanyl)phenyl]acetonitrile
Also Known As: 4-(Trifluoromethylthio)phenylacetonitrile|2-(4-((Trifluoromethyl)thio)phenyl)acetonitrile|2-[4-(trifluoromethylsulfanyl)phenyl]acetonitrile|AMY6259|2-{4-[(Trifluoromethyl)Sulfanyl]Phenyl}Acetonitrile|JRD-0712|0863AC|4-TRIFLUOROMETHYLTHIOBENZYLCYANIDE|4-trifluoromethylthiophenylacetonitrile|Benzeneacetonitrile, 4-[(trifluoromethyl)thio]-|4-[(Trifluoromethyl)thio]phenylacetonitrile|DS-6637|4-trifluoromethylmercapto-benzyl cyanide|{4-[(trifluoromethyl)sulfanyl]phenyl}acetonitrile|4 - (Trifluoromethylthio)phenylacetonitrile|{4-[(trifluoromethyl)thio]phenyl}acetonitrile|2-(4-(trifluoromethylthio)phenyl)acetonitrile|J3.035.881C|(4-Trifluoromethylsulfanyl-phenyl)-acetonitrile|{4-[(trifluoromethyl)thio]phenyl} acetonitrile|2-[4-(trifluoromethylthio)phenyl]ethanenitrile|C-0661|2-{4-(trifluoromethyl)sulfanylphenyl}acetonitrile|I09-3253|2-(4-[(TRIFLUOROMETHYL)SULFANYL]PHENYL)ACETONITRILE
| Molecular Formula | C9H6F3NS |
|---|---|
| Molecular Weight | 217.0173 g/mol |
| LogP | 3.36458 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.0173 |
| Monoisotopic Mass | 217.0173 |
| Heavy Atoms | 14 |
| Complexity | 336.5601 |
Chemical Identifiers
| CAS Number | 70124-90-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CC#N)SC(F)(F)F |
Product Overview
4-(Trifluoromethylthio)phenylacetonitrile (CAS 70124-90-2), with molecular formula C9H6F3NS and molecular weight 217.0173 g/mol. IUPAC: 2-[4-(trifluoromethylsulfanyl)phenyl]acetonitrile.
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