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Substance Name: Ammonium, 4,4'-biphenylenebis(2-oxoethylene)bis(triethyl-, dibromide
RN: 77967-04-5
InChIKey: DLDZEJWVJQPKIL-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H42-N2-O2.2Br

Molecular Weight

  • 598.46
 
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Names and Synonyms

Synonym

  • 4,4'-Biphenylenebis(2-oxoethylene)bis(triethylammonium) dibromide

Systematic Name

  • Ammonium, 4,4'-biphenylenebis(2-oxoethylene)bis(triethyl-, dibromide

Registry Numbers

CAS Registry Number

  • 77967-04-5

System Generated Number

  • 0077967045

Molecular Formulas

Molecular Formula

  • C28-H42-N2-O2.2Br

Molecular Formula Fragments

  • Br
  • C28-H42-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C28H42N2O2.2BrH/c1-7-29(8-2,9-3)27(31)21-23-13-17-25(18-14-23)26-19-15-24(16-20-26)22-28(32)30(10-4,11-5)12-6;;/h13-20H,7-12,21-22H2,1-6H3;2*1H/q+2;;/p-2

InChIKey

DLDZEJWVJQPKIL-UHFFFAOYSA-L

Smiles

[N+](C(Cc1ccc(c2ccc(CC([N+](CC)(CC)CC)=O)cc2)cc1)=O)(CC)(CC)CC.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1mg/kg (1mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 115, Pg. 127, 1955.