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Substance Name: Isoquinolinium, 2-phenacyl-, chloride
RN: 73825-51-1
InChIKey: YGUHRYCERCMKSD-UHFFFAOYSA-M

Molecular Formula

  • C17-H14-N-O.Cl

Molecular Weight

  • 283.757
 
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Names and Synonyms

Synonym

  • 2-Phenacylisoquinolinium chloride

Systematic Name

  • Isoquinolinium, 2-phenacyl-, chloride

Registry Numbers

CAS Registry Number

  • 73825-51-1

System Generated Number

  • 0073825511

Molecular Formulas

Molecular Formula

  • C17-H14-N-O.Cl

Molecular Formula Fragments

  • C17-H14-N-O
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C17H14NO.ClH/c19-17(15-7-2-1-3-8-15)13-18-11-10-14-6-4-5-9-16(14)12-18;/h1-12H,13H2;1H/q+1;/p-1

InChIKey

YGUHRYCERCMKSD-UHFFFAOYSA-M

Smiles

c12c(c[n+](CC(c3ccccc3)=O)cc1)cccc2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04034,