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4-(trifluoromethoxy)phenylacetonitrile

Catalog Number ACM49561968
CAS Number 49561-96-8
Synonyms Benzeneacetonitrile, 4-(trifluoromethoxy)-
IUPAC Name 2-[4-(trifluoromethoxy)phenyl]acetonitrile
Molecular Weight 201.15
Molecular Formula C9H6F3NO
Canonical SMILES C1=CC(=CC=C1CC#N)OC(F)(F)F
InChI InChI=1S/C9H6F3NO/c10-9(11,12)14-8-3-1-7(2-4-8)5-6-13/h1-4H,5H2
InChI Key LYFCAROXYJTUQF-UHFFFAOYSA-N
Boiling Point 96 °C 4mmHg
Melting Point 30-33 °C
Purity 98%+
Density 1.28 g/ml