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Substance Name: Nicotinic acid, 5-fluoro-, isopropyl ester (8CI)
RN: 23723-24-2
InChIKey: CHRVVWHJGOIAFG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H10-F-N-O2

Molecular Weight

  • 183.181
 
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Names and Synonyms

Synonyms

  • 1-Methylethyl 5-fluoro-3-pyridinecarboxylate
  • 5-22-02-00173 (Beilstein Handbook Reference)
  • BRN 0474224
  • Isopropyl 5-fluoronicotinate

Systematic Names

  • 3-Pyridinecarboxylic acid, 5-fluoro-, 1-methylethyl ester
  • Nicotinic acid, 5-fluoro-, isopropyl ester (8CI)

Registry Numbers

CAS Registry Number

  • 23723-24-2

System Generated Number

  • 0023723242

Structure Descriptors

InChI

1S/C9H10FNO2/c1-6(2)13-9(12)7-3-8(10)5-11-4-7/h3-6H,1-2H3

InChIKey

CHRVVWHJGOIAFG-UHFFFAOYSA-N

Smiles

c1c(cc(cn1)F)C(=O)OC(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Acta Pharmaceutica Suecica. Vol. 9, Pg. 221, 1972.