Cas no 101216-61-9 (7,9-Tetracosadiynoic acid)

7,9-Tetracosadiynoic acid structure
7,9-Tetracosadiynoic acid structure
Product Name:7,9-Tetracosadiynoic acid
CAS No:101216-61-9
MF:C24H40O2
MW:360.573207855225
CID:1128080
PubChem ID:13600590
Update Time:2025-04-20

7,9-Tetracosadiynoic acid Chemical and Physical Properties

Names and Identifiers

    • 7,9-Tetracosadiynoic acid
    • tetracosa-7,9-diynoic acid
    • 101216-61-9
    • DTXSID60544753
    • Inchi: 1S/C24H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h2-14,19-23H2,1H3,(H,25,26)
    • InChI Key: SPONCGBFIUEGSR-UHFFFAOYSA-N
    • SMILES: OC(CCCCCC#CC#CCCCCCCCCCCCCCC)=O

Computed Properties

  • Exact Mass: 360.303
  • Monoisotopic Mass: 360.302830514g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 18
  • Complexity: 452
  • 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: 9.6
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3
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