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Substance Name: Nicotinic acid, 4-(ethylthio)-, hydrobromide
RN: 74039-06-8
InChIKey: FNKCOKZUNFEDSM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H9-N-O2-S.Br-H

Molecular Weight

  • 264.142
 
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Names and Synonyms

Synonyms

  • 3-Pyridinecarboxylic acid, 4-ethylthio-, hydrobromide
  • 4-(Ethylthio)nicotinic acid hydrobromide
  • 4-Ethylthio-3-pyridinecarboxylic acid hydrobromide

Systematic Name

  • Nicotinic acid, 4-(ethylthio)-, hydrobromide

Registry Numbers

CAS Registry Number

  • 74039-06-8

System Generated Number

  • 0074039068

Molecular Formulas

Molecular Formula

  • C8-H9-N-O2-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C8-H9-N-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C8H9NO2S.BrH/c1-2-12-7-3-4-9-5-6(7)8(10)11;/h3-5H,2H2,1H3,(H,10,11);1H

InChIKey

FNKCOKZUNFEDSM-UHFFFAOYSA-N

Smiles

c1(c(cc[n+]c1)SCC)C(O)=O.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 14mg/kg (14mg/kg)   Journal of Medicinal Chemistry. Vol. 10, Pg. 257, 1967.