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Substance Name: Ammonium, hexamethylenebis(benzyldimethyl-, dibromide
RN: 13221-98-2
InChIKey: SXSCTOBLBXISDM-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H38-N2.2Br

Molecular Weight

  • 514.386
 
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Names and Synonyms

Synonym

  • Hexamethylenebis(benzyldimethylammonium bromide)

Systematic Name

  • Ammonium, hexamethylenebis(benzyldimethyl-, dibromide

Registry Numbers

CAS Registry Number

  • 13221-98-2

System Generated Number

  • 0013221982

Molecular Formulas

Molecular Formula

  • C24-H38-N2.2Br

Molecular Formula Fragments

  • Br
  • C24-H38-N2
  • COMPONENT

Structure Descriptors

InChI

1S/C24H38N2.2BrH/c1-25(2,21-23-15-9-7-10-16-23)19-13-5-6-14-20-26(3,4)22-24-17-11-8-12-18-24;;/h7-12,15-18H,5-6,13-14,19-22H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

SXSCTOBLBXISDM-UHFFFAOYSA-L

Smiles

c1(C[N+](CCCCCC[N+](Cc2ccccc2)(C)C)(C)C)ccccc1.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 3500ug/kg (3.5mg/kg)   Biochemical Pharmacology. Vol. 2, Pg. 233, 1959.