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Substance Name: Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide
RN: 69095-10-9
InChIKey: OZWMMAGTYOWNJK-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-N-O2.Br

Molecular Weight

  • 302.21
 
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Names and Synonyms

Synonyms

  • 1-(2-(Acetyloxy)ethyl)-4-(1,1-dimethylethyl)pyridinium bromide
  • HB 6

Systematic Name

  • Pyridinium, 1-(2-(acetyloxy)ethyl)-4-(1,1-dimethylethyl)-, bromide

Registry Numbers

CAS Registry Number

  • 69095-10-9

System Generated Number

  • 0069095109

Molecular Formulas

Molecular Formula

  • C13-H20-N-O2.Br

Molecular Formula Fragments

  • Br
  • C13-H20-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C13H20NO2.BrH/c1-11(15)16-10-9-14-7-5-12(6-8-14)13(2,3)4;/h5-8H,9-10H2,1-4H3;1H/q+1;/p-1

InChIKey

OZWMMAGTYOWNJK-UHFFFAOYSA-M

Smiles

CC(=O)OCC[n+]1ccc(cc1)C(C)(C)C.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 604mg/kg (604mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 177, 1979.