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Substance Name: m-Trifluoromethylphenylacetonitrile
RN: 2338-76-3
UNII: Z3BI56GK28
InChIKey: JOIYKSLWXLFGGR-UHFFFAOYSA-N

Molecular Formula

  • C9-H6-F3-N

Molecular Weight

  • 185.147
 
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Names and Synonyms

Name of Substance

  • m-Trifluoromethylphenylacetonitrile

Synonyms

  • 3-(Trifluoromethyl)benzeneacetonitrile
  • 3-(Trifluoromethyl)benzyl cyanide
  • 3-Trifluormethylbenzylcyanide
  • Benzeneacetonitrile, 3-(trifluoromethyl)-
  • BRN 0909640
  • EINECS 219-053-8
  • m-(Trifluoromethyl)benzylcyanide
  • m-Trifluoromethylphenylacetonitrile
  • UNII-Z3BI56GK28

Systematic Names

  • 3-(Trifluoromethyl)phenylacetonitrile
  • Acetonitrile, (alpha,alpha,alpha-trifluoro-m-tolyl)- (7CI,8CI)
  • Benzeneacetonitrile, 3-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 2338-76-3

FDA UNII

  • Z3BI56GK28

System Generated Number

  • 0002338763

Structure Descriptors

InChI

1S/C9H6F3N/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6H,4H2

InChIKey

JOIYKSLWXLFGGR-UHFFFAOYSA-N

Smiles

N#CCc1cccc(C(F)(F)F)c1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   National Technical Information Service. Vol. AD691-490,