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Substance Name: Ethylhexadecyldimethylammonium 4-chloro-3,5-dimethylphenolate
RN: 85940-57-4
InChIKey: ASODHYNKPDTQGL-UHFFFAOYSA-M

Molecular Formula

  • C20-H44-N.C8-H8-Cl-O

Molecular Weight

  • 454.1778
 
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Names and Synonyms

Synonym

  • EINECS 288-944-1

Systematic Name

  • Ethylhexadecyldimethylammonium 4-chloro-3,5-dimethylphenolate

Registry Numbers

CAS Registry Number

  • 85940-57-4

System Generated Number

  • 0085940574

Molecular Formulas

Molecular Formula

  • C20-H44-N.C8-H8-Cl-O

Molecular Formula Fragments

  • C20-H44-N
  • C8-H8-Cl-O
  • COMPONENT

Structure Descriptors

InChI

1S/C20H44N.C8H9ClO/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;1-5-3-7(10)4-6(2)8(5)9/h5-20H2,1-4H3;3-4,10H,1-2H3/q+1;/p-1

InChIKey

ASODHYNKPDTQGL-UHFFFAOYSA-M

Smiles

CCCCCCCCCCCCCCCC[N+](C)(C)CC.Cc1cc(cc(c1Cl)C)[O-]