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Substance Name: Indole-5-carbonitrile, 3-benzyl-
RN: 17380-31-3
InChIKey: FYYLYGUSDSKOPK-UHFFFAOYSA-N

Molecular Formula

  • C16-H12-N2

Molecular Weight

  • 232.285
 
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Names and Synonyms

Synonyms

  • 3-Benzyl-5-cyanoindole
  • 3-Benzylindole-5-carbonitrile

Systematic Name

  • Indole-5-carbonitrile, 3-benzyl-

Registry Numbers

CAS Registry Number

  • 17380-31-3

System Generated Number

  • 0017380313

Structure Descriptors

InChI

1S/C16H12N2/c17-10-13-6-7-16-15(9-13)14(11-18-16)8-12-4-2-1-3-5-12/h1-7,9,11,18H,8H2

InChIKey

FYYLYGUSDSKOPK-UHFFFAOYSA-N

Smiles

c12c(Cc3ccccc3)c[nH]c1ccc(c2)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 89mg/kg (89mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12386,