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Substance Name: Ethylhexadecyldimethylammonium 2-benzylphenolate
RN: 85940-56-3
InChIKey: WYBUQAHPDPUUSA-UHFFFAOYSA-M

Molecular Formula

  • C20-H44-N.C13-H11-O

Molecular Weight

  • 481.8035
 
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Names and Synonyms

Synonym

  • EINECS 288-943-6

Systematic Name

  • Ethylhexadecyldimethylammonium 2-benzylphenolate

Registry Numbers

CAS Registry Number

  • 85940-56-3

System Generated Number

  • 0085940563

Molecular Formulas

Molecular Formula

  • C20-H44-N.C13-H11-O

Molecular Formula Fragments

  • C13-H11-O
  • C20-H44-N
  • COMPONENT

Structure Descriptors

InChI

1S/C20H44N.C13H12O/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h5-20H2,1-4H3;1-9,14H,10H2/q+1;/p-1

InChIKey

WYBUQAHPDPUUSA-UHFFFAOYSA-M

Smiles

CCCCCCCCCCCCCCCC[N+](C)(C)CC.c1ccc(cc1)Cc2ccccc2[O-]