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Substance Name: Isoquinoline, 1-amino-3-(trifluoromethyl)-, monohydrochloride
RN: 37989-07-4
InChIKey: WBAZUSCJWSXCHL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H7-F3-N2.Cl-H

Molecular Weight

  • 248.6342
 
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Names and Synonyms

Synonyms

  • 1-Amino-3-(trifluoromethyl)isoquinoline monohydrochloride
  • 1-Isoquinolinamine, 3-(trifluoromethyl)-, monohydrochloride

Systematic Name

  • Isoquinoline, 1-amino-3-(trifluoromethyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 37989-07-4

System Generated Number

  • 0037989074

Molecular Formulas

Molecular Formula

  • C10-H7-F3-N2.Cl-H

Molecular Formula Fragments

  • C10-H7-F3-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C10H7F3N2.ClH/c11-10(12,13)8-5-6-3-1-2-4-7(6)9(14)15-8;/h1-5H,(H2,14,15);1H

InChIKey

WBAZUSCJWSXCHL-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)cc(nc2N)C(F)(F)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 100mg/kg (100mg/kg)   Chimica Therapeutica. Vol. 7, Pg. 185, 1972.