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Substance Name: Ammonium, (2,2-diphenyl-5-methyl-5-dioxanylmethyl)trimethyl-, bromide
RN: 73664-13-8
InChIKey: WAXRPIUDZHIYIF-UHFFFAOYSA-M

Molecular Formula

  • C21-H28-N-O2.Br

Molecular Weight

  • 406.361
 
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Names and Synonyms

Synonyms

  • (2,2-Diphenyl-5-methyl-5-dioxanylmethyl)trimethylammonium bromide
  • 2,2-Diphenyl-5-methyl-5-dimethylaminomethyl-1,3-dioxane methobromide

Systematic Name

  • Ammonium, (2,2-diphenyl-5-methyl-5-dioxanylmethyl)trimethyl-, bromide

Registry Numbers

CAS Registry Number

  • 73664-13-8

System Generated Number

  • 0073664138

Molecular Formulas

Molecular Formula

  • C21-H28-N-O2.Br

Molecular Formula Fragments

  • Br
  • C21-H28-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C21H28NO2.BrH/c1-20(15-22(2,3)4)16-23-21(24-17-20,18-11-7-5-8-12-18)19-13-9-6-10-14-19;/h5-14H,15-17H2,1-4H3;1H/q+1;/p-1

InChIKey

WAXRPIUDZHIYIF-UHFFFAOYSA-M

Smiles

C1(c2ccccc2)(c2ccccc2)OCC(C[N+](C)(C)C)(C)CO1.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100ug/kg (0.1mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04812,