Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ammonium, dimethyl(2-hydroxyethyl)undecyl-, bromide, benzilate
RN: 56927-41-4
InChIKey: ZAQWBHAIHRFGTI-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H44-N-O3.Br

Molecular Weight

  • 534.575
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • Benzilsaeure-dimethyl-undecyl-ammonium-aethylester-bromide
  • Benzilsaeure-dimethyl-undecyl-ammonium-aethylester-bromide [German]
  • Dimethyl(2-hydroxyethyl)undecylammonium bromide benzilate

Systematic Name

  • Ammonium, dimethyl(2-hydroxyethyl)undecyl-, bromide, benzilate

Registry Numbers

CAS Registry Number

  • 56927-41-4

System Generated Number

  • 0056927414

Molecular Formulas

Molecular Formula

  • C29-H44-N-O3.Br

Molecular Formula Fragments

  • Br
  • C29-H44-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C29H44NO3.BrH/c1-4-5-6-7-8-9-10-11-18-23-30(2,3)24-25-33-28(31)29(32,26-19-14-12-15-20-26)27-21-16-13-17-22-27;/h12-17,19-22,32H,4-11,18,23-25H2,1-3H3;1H/q+1;/p-1

InChIKey

ZAQWBHAIHRFGTI-UHFFFAOYSA-M

Smiles

C(c1ccccc1)(c1ccccc1)(C(OCC[N+](CCCCCCCCCCC)(C)C)=O)O.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 580mg/kg (580mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 10, Pg. 763, 1960.