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Substance Name: Cinnamylamine, N-benzyl-N-(2-chloroethyl)-o-methyl-, hydrochloride
RN: 63938-17-0
InChIKey: JCUYNWANICHYHR-RRAJOLSVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-Cl-N.Cl-H

Molecular Weight

  • 336.304
 
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Names and Synonyms

Synonyms

  • Benzenemethanamine, N-(2-chloroethyl)-N-(3-(2-methylphenyl)-2-propenyl)-, hydrochloride
  • N-Benzyl-N-(2-chloroethyl)-o-methylcinnamylamine hydrochloride

Systematic Name

  • Cinnamylamine, N-benzyl-N-(2-chloroethyl)-o-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 63938-17-0

System Generated Number

  • 0063938170

Molecular Formulas

Molecular Formula

  • C19-H22-Cl-N.Cl-H

Molecular Formula Fragments

  • C19-H22-Cl-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H22ClN.ClH/c1-17-8-5-6-11-19(17)12-7-14-21(15-13-20)16-18-9-3-2-4-10-18;/h2-12H,13-16H2,1H3;1H/b12-7+;

InChIKey

JCUYNWANICHYHR-RRAJOLSVSA-N

Smiles

c1(C[N@@H+](C\C=C\c2c(cccc2)C)CCCl)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 1gm/kg (1000mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 101, Pg. 379, 1951.