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Substance Name: Acetonitrile, (p-aminophenyl)(p-fluorophenyl)-, hydrochloride
RN: 73663-75-9
InChIKey: LYKFRKLBPHTPOU-UHFFFAOYSA-N

Molecular Formula

  • C14-H11-F-N2.Cl-H

Molecular Weight

  • 262.714
 
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Names and Synonyms

Synonyms

  • (p-Aminophenyl)(p-fluorophenyl)acetonitrile hydrochloride
  • Acetonitrile, (p-aminophenyl)(p-fluorophenyl)-, hydrochloride
  • alpha-(4-Aminophenyl)-4-fluorobenzyl cyanide hydrochloride
  • EINECS 277-562-0
  • NSC 102520

Systematic Names

  • (4-(Cyano(4-fluorophenyl)methyl)phenyl)ammonium chloride
  • Acetonitrile, (p-aminophenyl)(p-fluorophenyl)-, hydrochloride
  • Benzeneacetonitrile, 4-amino-alpha-(4-fluorophenyl)-, monohydrochloride (9CI)

Registry Numbers

CAS Registry Number

  • 73663-75-9

System Generated Number

  • 0073663759

Molecular Formulas

Molecular Formula

  • C14-H11-F-N2.Cl-H

Molecular Formula Fragments

  • C14-H11-F-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H11FN2.ClH/c15-12-5-1-10(2-6-12)14(9-16)11-3-7-13(17)8-4-11;/h1-8,14H,17H2;1H

InChIKey

LYKFRKLBPHTPOU-UHFFFAOYSA-N

Smiles

c1([C@@H](c2ccc([NH2+])cc2)C#N)ccc(F)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04671,