Benzoylcholine

CAS Registry Number®

2208-04-0

CAS Name

Benzoylcholine

Molecular Formula

C12H18NO2

Cite this Page

Benzoylcholine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2208-04-0 (retrieved 2024-11-29) (CAS RN: 2208-04-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    204-205 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=HOPVGFKDVOOCHD-UHFFFAOYSA-N

SMILES

C(OCC[N+](C)(C)C)(=O)C1=CC=CC=C1

Canonical SMILES

O=C(OCC[N+](C)(C)C)C=1C=CC=CC1

Other Names for this Substance

  • Ethanaminium, 2-(benzoyloxy)-N,N,N-trimethyl-
  • Choline, benzoate (ester)
  • Choline, benzoate
  • 2-(Benzoyloxy)-N,N,N-trimethylethanaminium
  • Benzoylcholine

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