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Substance Name: Cinnamonitrile, p-chloro-
RN: 28446-72-2
InChIKey: PPCNBCKABHGVMX-OWOJBTEDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H6-Cl-N

Molecular Weight

  • 163.606
 
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Names and Synonyms

Synonyms

  • 2-Propenenitrile, 3-(4-chlorophenyl)-
  • BRN 2206061
  • EINECS 249-025-0
  • p-Chlorocinnamonitrile

Systematic Names

  • 4-Chlorocinnamonitrile
  • Cinnamonitrile, p-chloro-

Registry Numbers

CAS Registry Number

  • 28446-72-2

System Generated Number

  • 0028446722

Structure Descriptors

InChI

1S/C9H6ClN/c10-9-5-3-8(4-6-9)2-1-7-11/h1-6H/b2-1+

InChIKey

PPCNBCKABHGVMX-OWOJBTEDSA-N

Smiles

c1(ccc(Cl)cc1)\C=C\C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 78mg/kg (78mg/kg)   Russian Pharmacology and Toxicology Vol. 46, Pg. 174, 1983.