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Substance Name: Aluminum behenate
RN: 18990-72-2
UNII: F6S45L9CH9
InChIKey: BBMXVTPBLPQMAE-UHFFFAOYSA-K

Molecular Formula

  • C22-H44-O2.1/3Al

Molecular Weight

  • 1045.72
 
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Names and Synonyms

Name of Substance

  • Aluminum behenate
  • Docosanoic acid, aluminum salt

Synonyms

  • Aluminum behenate
  • EINECS 242-726-2
  • UNII-F6S45L9CH9

Systematic Names

  • Aluminium tridocosanoate
  • Docosanoic acid, aluminum salt
  • Docosanoic acid, aluminum salt (3:1)

Registry Numbers

CAS Registry Number

  • 18990-72-2

FDA UNII

  • F6S45L9CH9

Other Registry Number

  • 63502-93-2

Related Registry Number

  • 112-85-6 (Parent)

System Generated Number

  • 0018990722

Molecular Formulas

Molecular Formula

  • C22-H44-O2.1/3Al

Molecular Formula Fragments

  • Al
  • C22-H44-O2
  • COMPONENT

Structure Descriptors

InChI

1S/3C22H44O2.Al/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24;/h3*2-21H2,1H3,(H,23,24);/q;;;+3/p-3

InChIKey

BBMXVTPBLPQMAE-UHFFFAOYSA-K

Smiles

[Al+3].C(=O)([O-])CCCCCCCCCCCCCCCCCCCCC.C(CCCCCCCCCCCCCCCCCCCCC)(=O)[O-].C(CCCCCCCCCCCCCCCCCCCCC)(=O)[O-]