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Substance Name: Cetrimonium tosylate
RN: 138-32-9
UNII: 1P489GK6AR
InChIKey: MZMRZONIDDFOGF-UHFFFAOYSA-M

Molecular Formula

  • C19-H42-N.C7-H7-O3-S

Molecular Weight

  • 455.7431
 
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Names and Synonyms

Name of Substance

  • 1-Hexadecanaminium, N,N,N-trimethyl-, salt with 4-methylbenzenesulfonic acid (1:1)
  • Cetrimonium tosylate
  • Cetyl trimethyl ammonium p-toluene sulfonate
  • N,N,N-Trimethyl-1-hexadecanaminium salt with 4-methylbenzenesulfonic acid
  • Trimethylcetylammonium p-toluenesulfonate

Synonyms

  • EINECS 205-324-8
  • UNII-1P489GK6AR

Systematic Names

  • 1-Hexadecanaminium, N,N,N-trimethyl-, 4-methylbenzenesulfonate (1:1)
  • 1-Hexadecanaminium, N,N,N-trimethyl-, salt with 4-methylbenzenesulfonic acid (1:1)
  • Hexadecyltrimethylammonium toluene-p-sulphonate
  • N,N,N-Trimethyl-1-hexadecanaminium, salt with 4-methylbenzenesulfonic acid (1:1)

Registry Numbers

CAS Registry Number

  • 138-32-9

FDA UNII

  • 1P489GK6AR

Other Registry Numbers

  • 57158-41-5
  • 84505-77-1

System Generated Number

  • 0000138329

Molecular Formulas

Molecular Formula

  • C19-H42-N.C7-H7-O3-S

Molecular Formula Fragments

  • C19-H42-N
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C19H42N.C7H8O3S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;1-6-2-4-7(5-3-6)11(8,9)10/h5-19H2,1-4H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

InChIKey

MZMRZONIDDFOGF-UHFFFAOYSA-M

Smiles

CCCCCCCCCCCCCCCC[N+](C)(C)C.Cc1ccc(cc1)S(=O)(=O)[O-]