Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Choline, chloride, benzoate
RN: 2964-09-2
InChIKey: QVFHQENRNSAHEK-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-N-O2.Cl

Molecular Weight

  • 243.732
 
* 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

  • (2-Hydroxyethyl)trimethylammonium chloride benzoate
  • 2-(Benzyloxy)-N,N,N-trimethylethanaminimum chloride
  • 2-(Benzyloxy)-N,N,N-trimethylethanaminium chloride
  • Ammonium, (2-hydroxyethyl)trimethyl-, chloride, benzoate
  • Benzoylcholine chloride
  • EINECS 221-000-9

Systematic Names

  • 2-Benzoyloxyethyltrimethylammonium chloride
  • Choline, chloride, benzoate
  • Ethanaminium, 2-(benzyloxy)-N,N,N-trimethyl-, chloride (9CI)

Registry Numbers

CAS Registry Number

  • 2964-09-2

System Generated Number

  • 0002964092

Molecular Formulas

Molecular Formula

  • C12-H18-N-O2.Cl

Molecular Formula Fragments

  • C12-H18-N-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C12H18NO2.ClH/c1-13(2,3)9-10-15-12(14)11-7-5-4-6-8-11;/h4-8H,9-10H2,1-3H3;1H/q+1;/p-1

InChIKey

QVFHQENRNSAHEK-UHFFFAOYSA-M

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 49mg/kg (49mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Farmakologiya i Toksikologiya Vol. 20(4), Pg. 32, 1957.
mouse LDLo subcutaneous 2gm/kg (2000mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 1, Pg. 303, 1909.