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Substance Name: Cinnamonitrile, 3,4-dimethoxy-alpha-phenyl-
RN: 21132-40-1
InChIKey: PQQFKZSOPMQHDN-GDNBJRDFSA-N

Molecular Formula

  • C17-H15-N-O2

Molecular Weight

  • 265.31
 
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Names and Synonyms

Synonyms

  • 3,4-Dimethoxy-alpha-phenylcinnamonitrile
  • Acrylonitrile, 3-(3,4-dimethoxyphenyl)-2-phenyl-
  • Benzeneacetonitrile, beta-(3,4-dimethoxybenzylidene)-

Systematic Name

  • Cinnamonitrile, 3,4-dimethoxy-alpha-phenyl-

Registry Numbers

CAS Registry Number

  • 21132-40-1

System Generated Number

  • 0021132401

Structure Descriptors

InChI

1S/C17H15NO2/c1-19-16-9-8-13(11-17(16)20-2)10-15(12-18)14-6-4-3-5-7-14/h3-11H,1-2H3/b15-10-

InChIKey

PQQFKZSOPMQHDN-GDNBJRDFSA-N

Smiles

c1(\C=C(/c2ccccc2)C#N)cc(c(OC)cc1)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 320mg/kg (320mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04171,