Choline salicylate

CAS Registry Number®

2016-36-6

CAS Name

Choline salicylate

Molecular Formula

C7H5O3.C5H14NO

Cite this Page

Choline salicylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2016-36-6 (retrieved 2024-11-22) (CAS RN: 2016-36-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    49-50 °C

  • Density (2)

    1.168177 g/cm³ @ Temp: 40 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H6O3.C5H14NO/c8-6-4-2-1-3-5(6)7(9)10;1-6(2,3)4-5-7/h1-4,8H,(H,9,10);7H,4-5H2,1-3H3/q;+1/p-1

InChIKey

InChIKey=UDKCHVLMFQVBAA-UHFFFAOYSA-M

SMILES

C([O-])(=O)C1=C(O)C=CC=C1.C([N+](C)(C)C)CO

Canonical SMILES

O=C([O-])C=1C=CC=CC1O.OCC[N+](C)(C)C

Other Names for this Substance

  • Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, 2-hydroxybenzoate (1:1)
  • Choline, salicylate (salt)
  • Choline salicylate
  • Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, salt with 2-hydroxybenzoic acid (1:1)
  • Salicylic acid, ion(1-), choline

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Deleted or Replaced CAS Registry Numbers

54391-51-4, 2093200-84-9

CAS INSIGHTSTM
Targeted protein degrader structure, illustration