Cas no 6708-53-8 (Triacontanedioic Acid)

Triacontanedioic Acid structure
Triacontanedioic Acid structure
Product Name:Triacontanedioic Acid
CAS No:6708-53-8
MF:C30H58O4
MW:482.779130458832
CID:1714825
PubChem ID:5322010
Update Time:2025-04-21

Triacontanedioic Acid Chemical and Physical Properties

Names and Identifiers

    • Triacontanedioic Acid
    • Equisetolic acid
    • LMFA01170042
    • CHEBI:165389
    • SCHEMBL1236072
    • 6708-53-8
    • DTXSID30415789
    • Inchi: 1S/C30H58O4/c31-29(32)27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30(33)34/h1-28H2,(H,31,32)(H,33,34)
    • InChI Key: JADFUOUIMWDTFX-UHFFFAOYSA-N
    • SMILES: OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O)=O

Computed Properties

  • Exact Mass: 482.43351033g/mol
  • Monoisotopic Mass: 482.43351033g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 34
  • Rotatable Bond Count: 29
  • Complexity: 396
  • 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: 12.9
  • Topological Polar Surface Area: 74.6?2
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