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Substance Name: Choline, chloride, p-aminobenzoate
RN: 21106-24-1
InChIKey: JUXRIMBOGMSYNW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H19-N2-O2.Cl

Molecular Weight

  • 258.747
 
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Names and Synonyms

Synonyms

  • Benzoic acid, p-amino ester with choline chloride
  • p-Aminobenzoylcholine chloride

Systematic Name

  • Choline, chloride, p-aminobenzoate

Registry Numbers

CAS Registry Number

  • 21106-24-1

System Generated Number

  • 0021106241

Molecular Formulas

Molecular Formula

  • C12-H19-N2-O2.Cl

Molecular Formula Fragments

  • C12-H19-N2-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C12H18N2O2.ClH/c1-14(2,3)8-9-16-12(15)10-4-6-11(13)7-5-10;/h4-7H,8-9H2,1-3H3,(H-,13,15);1H

InChIKey

JUXRIMBOGMSYNW-UHFFFAOYSA-N

Smiles

[N+](CCOC(c1ccc(cc1)N)=O)(C)(C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1811ug/kg (1.811mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Archives Internationales de Pharmacodynamie et de Therapie. Vol. 176, Pg. 443, 1968.