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Substance Name: Ammonium, (p-terphenyl-4,4''-ylene)bis(2-oxoethylene)bis(pentyldimethyl-, dibromide
RN: 73206-32-3
InChIKey: LSOJWFGMALJYER-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C36-H50-N2-O2.2Br

Molecular Weight

  • 702.611
 
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Names and Synonyms

Synonyms

  • (4,4'-(1,1':4',1''-Terphenylene))bis(2-oxoethylene)bis(1-pentyldimethylammonium bromide)
  • (p-Terphenyl-4,4''-ylene)bis(2-oxoethylene)bis(pentyldimethylammoniumbromide)

Systematic Name

  • Ammonium, (p-terphenyl-4,4''-ylene)bis(2-oxoethylene)bis(pentyldimethyl-, dibromide

Registry Numbers

CAS Registry Number

  • 73206-32-3

System Generated Number

  • 0073206323

Molecular Formulas

Molecular Formula

  • C36-H50-N2-O2.2Br

Molecular Formula Fragments

  • Br
  • C36-H50-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C36H50N2O2.2BrH/c1-7-9-11-25-37(3,4)27-35(39)33-21-17-31(18-22-33)29-13-15-30(16-14-29)32-19-23-34(24-20-32)36(40)28-38(5,6)26-12-10-8-2;;/h13-24H,7-12,25-28H2,1-6H3;2*1H/q+2;;/p-2

InChIKey

LSOJWFGMALJYER-UHFFFAOYSA-L

Smiles

CCCCC[N+](C)(C)CC(=O)c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)C(=O)C[N+](C)(C)CCCCC.[Br-].[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 5320ug/kg (5.32mg/kg)   Journal of Medicinal Chemistry. Vol. 23, Pg. 541, 1980.