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Substance Name: 1(2H)-Quinoxalineacrylic acid, 3,4-dihydro-alpha-cyano-, ethyl ester
RN: 6687-89-4
InChIKey: BMVPZMMXQCAFDS-ZHACJKMWSA-N

Molecular Formula

  • C14-H15-N3-O2

Molecular Weight

  • 257.292
 
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Names and Synonyms

Synonyms

  • 5-23-06-00026 (Beilstein Handbook Reference)
  • alpha-Cyano-3,4-dihydro-1(2H)-quinoxalineacrylic acid ethyl ester
  • BRN 0547976
  • NSC 90843

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 6687-89-4

System Generated Number

  • 0006687894

Structure Descriptors

InChI

1S/C14H15N3O2/c1-2-19-14(18)11(9-15)10-17-8-7-16-12-5-3-4-6-13(12)17/h3-6,10,16H,2,7-8H2,1H3/b11-10+

InChIKey

BMVPZMMXQCAFDS-ZHACJKMWSA-N

Smiles

C(=C\N1c2c(cccc2)NCC1)(\C(=O)OCC)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04340,