Cas no 10327-54-5 (Aluminum;tridecanoate)

Aluminum;tridecanoate structure
Aluminum;tridecanoate structure
Product Name:Aluminum;tridecanoate
CAS No:10327-54-5
MF:C39H75AlO6
MW:666.990752458572
CID:2657014
PubChem ID:22072702
Update Time:2025-04-21

Aluminum;tridecanoate Chemical and Physical Properties

Names and Identifiers

    • Tritridecanoic acid aluminum salt
    • Aluminum;tridecanoate
    • 10327-54-5
    • Inchi: 1S/3C13H26O2.Al/c3*1-2-3-4-5-6-7-8-9-10-11-12-13(14)15;/h3*2-12H2,1H3,(H,14,15);/q;;;+3/p-3
    • InChI Key: HGORXCDTVCJWHD-UHFFFAOYSA-K
    • SMILES: [Al+3].[O-]C(CCCCCCCCCCCC)=O.[O-]C(CCCCCCCCCCCC)=O.[O-]C(CCCCCCCCCCCC)=O

Computed Properties

  • Exact Mass: 666.537903g/mol
  • Monoisotopic Mass: 666.537903g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 46
  • Rotatable Bond Count: 30
  • Complexity: 138
  • Covalently-Bonded Unit Count: 4
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 667g/mol
  • Topological Polar Surface Area: 120?2
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