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Substance Name: 2,5-Cyclohexadien-1-one, 3-bromo-4-hydroxyimino-
RN: 13362-38-4
InChIKey: IOXVFTDDELLSSU-VURMDHGXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H4-Br-N-O2

Molecular Weight

  • 202.007
 
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Names and Synonyms

Synonyms

  • 2,5-Cyclohexadien-1-one, 3-bromo-4-hydroxyimino-
  • 3-Bromo-4-hydroxyimino-2,5-cyclohexadiene-1-one
  • 4-07-00-02085 (Beilstein Handbook Reference)
  • BRN 1939365
  • NSC 239651
  • p-Benzoquinone, bromo-, 1-oxime

Systematic Names

  • 2,5-Cyclohexadien-1-one, 3-bromo-4-hydroxyimino-
  • 2,5-Cyclohexadiene-1,4-dione, 2-bromo-, 1-oxime (9CI)
  • p-Benzoquinone, 2-bromo-, 1-oxime (8CI)

Registry Numbers

CAS Registry Number

  • 13362-38-4

System Generated Number

  • 0013362384

Structure Descriptors

InChI

1S/C6H4BrNO2/c7-5-3-4(9)1-2-6(5)8-10/h1-3,10H/b8-6-

InChIKey

IOXVFTDDELLSSU-VURMDHGXSA-N

Smiles

C\1(=CC(C=CC1=N/O)=O)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1090mg/kg (1090mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 11, 1978.