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Substance Name: Nicotinamide, N-(m-difluoromethoxyphenyl)-, hydrochloride
RN: 64038-00-2
InChIKey: FNUKUPRWKAMWNL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H10-F2-N2-O2.Cl-H

Molecular Weight

  • 300.691
 
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Names and Synonyms

Synonyms

  • m-Difluoromethoxyphenylamide of nicotinic acid hydrochloride
  • N-(m-Difluoromethoxyphenyl)nicotinamide hydrochloride

Systematic Name

  • Nicotinamide, N-(m-difluoromethoxyphenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 64038-00-2

System Generated Number

  • 0064038002

Molecular Formulas

Molecular Formula

  • C13-H10-F2-N2-O2.Cl-H

Molecular Formula Fragments

  • C13-H10-F2-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H10F2N2O2.ClH/c14-13(15)19-11-5-1-4-10(7-11)17-12(18)9-3-2-6-16-8-9;/h1-8,13H,(H,17,18);1H

InChIKey

FNUKUPRWKAMWNL-UHFFFAOYSA-N

Smiles

C(c1cnccc1)(Nc1cc(OC(F)F)ccc1)=O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 690mg/kg (690mg/kg)   Pharmaceutical Chemistry Journal Vol. 8, Pg. 469, 1974.