Choline magnesium trisalicylate

CAS Registry Number®

64425-90-7

CAS Name

Choline magnesium trisalicylate

Molecular Formula

C14H10MgO6.C7H5O3.C5H14NO

Cite this Page

Choline magnesium trisalicylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=64425-90-7 (retrieved 2024-11-28) (CAS RN: 64425-90-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/3C7H6O3.C5H14NO.Mg/c3*8-6-4-2-1-3-5(6)7(9)10;1-6(2,3)4-5-7;/h3*1-4,8H,(H,9,10);7H,4-5H2,1-3H3;/q;;;+1;+2/p-3

InChIKey

InChIKey=FQCQGOZEWWPOKI-UHFFFAOYSA-K

SMILES

O=C1[O-][Mg+2]2([OH]C=3C(C(=O)[O-]2)=CC=CC3)[OH]C=4C1=CC=CC4.C([O-])(=O)C1=C(O)C=CC=C1.C([N+](C)(C)C)CO

Canonical SMILES

O=C([O-])C=1C=CC=CC1O.O=C1[O-][Mg+2]2([O-]C(=O)C=3C=CC=CC3[OH]2)[OH]C=4C=CC=CC14.OCC[N+](C)(C)C

Other Names for this Substance

  • Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, 2-hydroxybenzoate (1:1), mixt. with (T-4)-bis[2-(hydroxy-κO)benzoato-κO]magnesium
  • Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, salt with 2-hydroxybenzoic acid (1:1), mixt. with (T-4)-bis(2-hydroxybenzoato-O1,O2)magnesium
  • Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, salt with 2-hydroxybenzoic acid (1:1), mixt. with (T-4)-bis[2-(hydroxy-κO)benzoato-κO]magnesium
  • Benzoic acid, 2-hydroxy-, ion(1-), 2-hydroxy-N,N,N-trimethylethanaminium, mixt. contg.
  • Benzoic acid, 2-hydroxy-, magnesium salt (2:1), mixt. contg.

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Deleted or Replaced CAS Registry Numbers

66798-25-2, 366803-09-0, 2093200-85-0

CAS INSIGHTSTM
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