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2-Chloro-5-(trifluoromethyl)benzonitrile

Catalog Number ACM328870
CAS Number 328-87-0
Synonyms 4-Chloro-3-cyanbenzotrifluoride
IUPAC Name 2-chloro-5-(trifluoromethyl)benzonitrile
Molecular Weight 205.56
Molecular Formula C8H3ClF3N
Canonical SMILES C1=CC(=C(C=C1C(F)(F)F)C#N)Cl
InChI InChI=1S/C8H3ClF3N/c9-7-2-1-6(8(10,11)12)3-5(7)4-13/h1-3H
InChI Key LCISFYAQKHOWBP-UHFFFAOYSA-N
Boiling Point 210-212 °C (lit.)
Melting Point 38-42 °C (lit.)
Purity 98%+
Density 1.481 g/ml