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Substance Name: 2,4-Pentadienoic acid, 2-cyano-5-phenyl-, ethyl ester
RN: 24139-56-8
InChIKey: LXDIOTPAZODMST-DEKJKZHBSA-N

Molecular Formula

  • C14-H13-N-O2

Molecular Weight

  • 227.262
 
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Names and Synonyms

Synonyms

  • 1-09-00-00397 (Beilstein Handbook Reference)
  • 2-Cyano-5-phenyl-2,4-pentadienoic acid ethyl ester
  • BRN 2108937
  • NSC 85627

Systematic Name

  • 2,4-Pentadienoic acid, 2-cyano-5-phenyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 24139-56-8

System Generated Number

  • 0024139568

Structure Descriptors

InChI

1S/C14H13NO2/c1-2-17-14(16)13(11-15)10-6-9-12-7-4-3-5-8-12/h3-10H,2H2,1H3/b9-6+,13-10+

InChIKey

LXDIOTPAZODMST-DEKJKZHBSA-N

Smiles

C(\C(=O)OCC)(C#N)=C\C=C\c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 32mg/kg (32mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02882,