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Substance Name: Bromopyruvate
RN: 1113-59-3
UNII: 63JMV04GRK
InChIKey: PRRZDZJYSJLDBS-UHFFFAOYSA-N

Classification Codes

  • Affinity Labels
  • Enzyme Inhibitors
  • Indicators and Reagents

Molecular Formula

  • C3-H3-Br-O3

Molecular Weight

  • 166.9577
 
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Names and Synonyms

Name of Substance

  • Bromopyruvate

Synonyms

  • 3-03-00-01167 (Beilstein Handbook Reference)
  • 3-Bromo-2-oxopropanoic acid
  • 3-Bromopyruvate
  • 3-Bromopyruvic acid
  • BRN 1746786
  • Bromopyruvic acid
  • EINECS 214-206-5
  • NSC 11731
  • NSC 62343
  • Pyruvic acid, bromo-
  • UNII-63JMV04GRK

Systematic Names

  • 3-Bromo-2-oxopropionic acid
  • Propanoic acid, 3-bromo-2-oxo-
  • Pyruvic acid, bromo-

Registry Numbers

CAS Registry Number

  • 1113-59-3

FDA UNII

  • 63JMV04GRK

System Generated Number

  • 0001113593

Structure Descriptors

InChI

1S/C3H3BrO3/c4-1-2(5)3(6)7/h1H2,(H,6,7)

InChIKey

PRRZDZJYSJLDBS-UHFFFAOYSA-N

Smiles

C(C(=O)C(=O)O)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 72mg/kg (72mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION
Journal of Pharmacology and Experimental Therapeutics. Vol. 123, Pg. 48, 1958.