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Substance Name: 1(2H)-Quinolineacrylic acid, 3,4-dihydro-alpha-cyano-, ethyl ester
RN: 6687-86-1
InChIKey: CQQPOEPVLMKPHG-ACCUITESSA-N

Molecular Formula

  • C15-H16-N2-O2

Molecular Weight

  • 256.303
 
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Names and Synonyms

Synonyms

  • 1(2H)-Quinolineacrylic acid, alpha-cyano-3,4-dihydro-, ethyl ester
  • 5-20-06-00305 (Beilstein Handbook Reference)
  • BRN 1687308
  • NSC 82503

Systematic Names

  • 1(2H)-Quinolineacrylic acid, 3,4-dihydro-alpha-cyano-, ethyl ester
  • 2-Propenoic acid, 2-cyano-3-(3,4-dihydro-1(2H)-quinolinyl)-, ethyl ester (9CI)

Registry Numbers

CAS Registry Number

  • 6687-86-1

System Generated Number

  • 0006687861

Structure Descriptors

InChI

1S/C15H16N2O2/c1-2-19-15(18)13(10-16)11-17-9-5-7-12-6-3-4-8-14(12)17/h3-4,6,8,11H,2,5,7,9H2,1H3/b13-11+

InChIKey

CQQPOEPVLMKPHG-ACCUITESSA-N

Smiles

C(=C\N1c2c(cccc2)CCC1)(\C(=O)OCC)C#N

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#02716,