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Substance Name: Isonicotinamide, N-(2,3-dimethylphenyl)-, hydrochloride
RN: 54231-55-9
InChIKey: NBSUZFZWVGDSEV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H14-N2-O.Cl-H

Molecular Weight

  • 262.738
 
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Names and Synonyms

Synonyms

  • Isonicotinamide, N-(2,3-xylyl)-, hydrochloride
  • N-(2,3-Dimethylphenyl)isonicotinamide hydrochloride
  • N-(2,3-Xylyl)isonicotinamide hydrochloride

Systematic Name

  • Isonicotinamide, N-(2,3-dimethylphenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 54231-55-9

System Generated Number

  • 0054231559

Molecular Formulas

Molecular Formula

  • C14-H14-N2-O.Cl-H

Molecular Formula Fragments

  • C14-H14-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H14N2O.ClH/c1-10-4-3-5-13(11(10)2)16-14(17)12-6-8-15-9-7-12;/h3-9H,1-2H3,(H,16,17);1H

InChIKey

NBSUZFZWVGDSEV-UHFFFAOYSA-N

Smiles

c1([NH+]C(c2ccncc2)=O)c(c(ccc1)C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 663mg/kg (663mg/kg)   Pharmaceutical Chemistry Journal Vol. 8, Pg. 469, 1974.