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Substance Name: 2,4,6-Tris(dimethylaminomethyl)phenol, stearate
RN: 64426-45-5
UNII: JS59I18J98
InChIKey: OGSBMEJBNLIKFH-UHFFFAOYSA-N

Molecular Formula

  • C18-H36-O2.1/3C15-H27-N3-O

Molecular Weight

  • 1118.84
 
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Names and Synonyms

Name of Substance

  • 2,4,6-Tris(dimethylaminomethyl)phenol, stearate

Synonyms

  • 2,4,6-Tris(dimethylaminomethyl)phenol stearic acid salt (1:3)
  • 2,4,6-Tris(dimethylaminomethyl)phenol, stearate
  • UNII-JS59I18J98

Systematic Name

  • Octadecanoic acid, compd. with 2,4,6-tris((dimethylamino)methyl)phenol (3:1)

Registry Numbers

CAS Registry Number

  • 64426-45-5

FDA UNII

  • JS59I18J98

System Generated Number

  • 0064426455

Molecular Formulas

Molecular Formula

  • C18-H36-O2.1/3C15-H27-N3-O

Molecular Formula Fragments

  • C15-H27-N3-O
  • C18-H36-O2
  • COMPONENT

Structure Descriptors

InChI

1S/3C18H36O2.C15H27N3O/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-16(2)9-12-7-13(10-17(3)4)15(19)14(8-12)11-18(5)6/h3*2-17H2,1H3,(H,19,20);7-8,19H,9-11H2,1-6H3

InChIKey

OGSBMEJBNLIKFH-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCCCC(O)=O.CN(C)Cc1cc(cc(c1O)CN(C)C)CN(C)C.CCCCCCCCCCCCCCCCCC(O)=O.CCCCCCCCCCCCCCCCCC(O)=O