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Substance Name: Ammonium, (alpha-carboxybenzyl)trimethyl-, bromide, ethyl ester
ID: BP20300000
InChIKey: KQOOGEGDXQKMMI-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

Synonym

  • (alpha-Carboxybenzyl)trimethylammonium bromide ethyl ester

Systematic Name

  • Ammonium, (alpha-carboxybenzyl)trimethyl-, bromide, ethyl ester

Registry Numbers

ID Number

  • NIOSH/BP2030000

System Generated Number

  • BP20300000

Molecular Formulas

Molecular Formula

  • C13-H20-N-O2.Br

Molecular Formula Fragments

  • Br
  • C13-H20-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C13H20NO2.BrH/c1-5-16-13(15)12(14(2,3)4)11-9-7-6-8-10-11;/h6-10,12H,5H2,1-4H3;1H/q+1;/p-1

InChIKey

KQOOGEGDXQKMMI-UHFFFAOYSA-M

Smiles

[Br-].CCOC(=O)C(c1ccccc1)[N+](C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 209mg/kg (209mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 1, Pg. 303, 1909.