Cas no 89131-65-7 (Undecanedioic acid, 6,6-dimethyl-)

Undecanedioic acid, 6,6-dimethyl- structure
89131-65-7 structure
Product Name:Undecanedioic acid, 6,6-dimethyl-
CAS No:89131-65-7
MF:C13H24O4
MW:244.327264785767
CID:611299
PubChem ID:71322271
Update Time:2025-04-19

Undecanedioic acid, 6,6-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • Undecanedioic acid, 6,6-dimethyl-
    • 6,6-dimethylundecanedioic acid
    • 89131-65-7
    • DTXSID00751969
    • Inchi: 1S/C13H24O4/c1-13(2,9-5-3-7-11(14)15)10-6-4-8-12(16)17/h3-10H2,1-2H3,(H,14,15)(H,16,17)
    • InChI Key: ZSDKOWPYUICFQN-UHFFFAOYSA-N
    • SMILES: OC(CCCCC(C)(C)CCCCC(=O)O)=O

Computed Properties

  • Exact Mass: 244.16745924g/mol
  • Monoisotopic Mass: 244.16745924g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 10
  • Complexity: 222
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 74.6?2
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