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Substance Name: 1,3,5-Pentanetricarbonitrile, 3-phenyl-
RN: 16320-20-0
InChIKey: KVDYEBISIZWSRT-UHFFFAOYSA-N

Molecular Formula

  • C14-H13-N3

Molecular Weight

  • 223.278
 
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Names and Synonyms

Synonyms

  • 3-09-00-04813 (Beilstein Handbook Reference)
  • 3-Phenyl-1,3,5-pentanetricarbonitrile
  • BRN 2619947

Systematic Name

  • 1,3,5-Pentanetricarbonitrile, 3-phenyl-

Registry Numbers

CAS Registry Number

  • 16320-20-0

System Generated Number

  • 0016320200

Structure Descriptors

InChI

1S/C14H13N3/c15-10-4-8-14(12-17,9-5-11-16)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-9H2

InChIKey

KVDYEBISIZWSRT-UHFFFAOYSA-N

Smiles

N#CC(c1ccccc1)(CCC#N)CCC#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 31, 1953.