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Substance Name: 3-Fluoropyruvate
RN: 433-48-7
UNII: 040OM3QF5R
InChIKey: CXABZTLXNODUTD-UHFFFAOYSA-N

Note

  • A substrate for E coli pyruvate dehydrogenase.

Molecular Formula

  • C3-H4-N-F-O3

Molecular Weight

  • 106.0517
 
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Names and Synonyms

Name of Substance

  • 3-Fluoropyruvate

Synonyms

  • 3-Fluoro-2-oxopropanoic acid
  • 4-03-00-01518 (Beilstein Handbook Reference)
  • BRN 1746780
  • Fluoropyruvate
  • Fluoropyruvic acid
  • NSC 21734
  • Pyruvic acid, 3-fluoro-
  • UNII-040OM3QF5R

Systematic Names

  • Propanoic acid, 3-fluoro-2-oxo- (9CI)
  • Pyruvic acid, 3-fluoro
  • Pyruvic acid, fluoro- (8CI)

Registry Numbers

CAS Registry Number

  • 433-48-7

FDA UNII

  • 040OM3QF5R

Related Registry Number

  • 2923-22-0 (hydrochloride salt)

System Generated Number

  • 0000433487

Structure Descriptors

InChI

1S/C3H3FO3/c4-1-2(5)3(6)7/h1H2,(H,6,7)

InChIKey

CXABZTLXNODUTD-UHFFFAOYSA-N

Smiles

C(C(=O)C(=O)O)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 125mg/kg (125mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Journal of Pharmacology and Experimental Therapeutics. Vol. 123, Pg. 48, 1958.
mouse LD50 unreported 80mg/kg (80mg/kg)   Nature. Vol. 173, Pg. 126, 1954.
rat LD50 unreported 80mg/kg (80mg/kg)   Nature. Vol. 173, Pg. 126, 1954.