Cas no 5617-97-0 (9-cyclopropylnonanoic acid)

9-cyclopropylnonanoic acid structure
9-cyclopropylnonanoic acid structure
Product Name:9-cyclopropylnonanoic acid
CAS No:5617-97-0
MF:C12H22O2
MW:198.301884174347
CID:349566
PubChem ID:15579939
Update Time:2025-04-19

9-cyclopropylnonanoic acid Chemical and Physical Properties

Names and Identifiers

    • Cyclopropanenonanoic acid
    • 9-cyclopropylnonanoic acid
    • DTXSID20574814
    • LMFA01140056
    • Z1262515364
    • SCHEMBL11848931
    • EN300-1073349
    • 5617-97-0
    • AKOS030592825
    • YVSYMQVXJYGAJL-UHFFFAOYSA-N
    • 9-cyclopropylnonanoicacid
    • Inchi: 1S/C12H22O2/c13-12(14)8-6-4-2-1-3-5-7-11-9-10-11/h11H,1-10H2,(H,13,14)
    • InChI Key: YVSYMQVXJYGAJL-UHFFFAOYSA-N
    • SMILES: OC(CCCCCCCCC1CC1)=O

Computed Properties

  • Exact Mass: 198.16206
  • Monoisotopic Mass: 198.161979940g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 9
  • Complexity: 162
  • 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: 4.7
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3

9-cyclopropylnonanoic acid Pricemore >>

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