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Substance Name: Nicotinic acid, 5-fluoro-, hexyl ester (8CI)
RN: 23723-19-5
InChIKey: MQTGTJYYMUSIPL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-F-N-O2

Molecular Weight

  • 225.261
 
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Names and Synonyms

Synonyms

  • BRN 0476298
  • Hexyl 5-fluoro-3-pyridinecarboxylate
  • Hexyl 5-fluoronicotinate

Systematic Names

  • 3-Pyridinecarboxylic acid, 5-fluoro-, hexyl ester
  • Nicotinic acid, 5-fluoro-, hexyl ester (8CI)

Registry Numbers

CAS Registry Number

  • 23723-19-5

System Generated Number

  • 0023723195

Structure Descriptors

InChI

1S/C12H16FNO2/c1-2-3-4-5-6-16-12(15)10-7-11(13)9-14-8-10/h7-9H,2-6H2,1H3

InChIKey

MQTGTJYYMUSIPL-UHFFFAOYSA-N

Smiles

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

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.