Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ammonium, diethyl(alpha-(hydroxymethyl)benzyl)methyl-, bromide, diphenylacetate
RN: 102612-55-5
InChIKey: XCKJQDINEYRWRE-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H32-N-O2.Br

Molecular Weight

  • 482.4588
 
* 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

  • Diethyl(alpha-(hydroxymethyl)benzyl)methylammonium bromide diphenylacetate
  • FC 612/A

Systematic Name

  • Ammonium, diethyl(alpha-(hydroxymethyl)benzyl)methyl-, bromide, diphenylacetate

Registry Numbers

CAS Registry Number

  • 102612-55-5

System Generated Number

  • 0102612555

Molecular Formulas

Molecular Formula

  • C27-H32-N-O2.Br

Molecular Formula Fragments

  • Br
  • C27-H32-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C27H32NO2.BrH/c1-4-28(3,5-2)25(22-15-9-6-10-16-22)21-30-27(29)26(23-17-11-7-12-18-23)24-19-13-8-14-20-24;/h6-20,25-26H,4-5,21H2,1-3H3;1H/q+1;/p-1

InChIKey

XCKJQDINEYRWRE-UHFFFAOYSA-M

Smiles

CC[N+](C)(CC)C(COC(=O)C(c1ccccc1)c2ccccc2)c3ccccc3.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 38mg/kg (38mg/kg)   Farmaco, Edizione Scientifica. Vol. 19, Pg. 588, 1964.