Cas no 875247-07-7 (3-Heptadecen-2-one)

3-Heptadecen-2-one structure
3-Heptadecen-2-one structure
Product Name:3-Heptadecen-2-one
CAS No:875247-07-7
MF:C17H32O
MW:252.435385704041
CID:655412
PubChem ID:54217242
Update Time:2025-04-19

3-Heptadecen-2-one Chemical and Physical Properties

Names and Identifiers

    • 3-Heptadecen-2-one
    • heptadec-3-en-2-one
    • heptadecen-2-one
    • 875247-07-7
    • DTXSID90709833
    • Inchi: 1S/C17H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18/h15-16H,3-14H2,1-2H3
    • InChI Key: QABMZKHISPGULD-UHFFFAOYSA-N
    • SMILES: O=C(C)C=CCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 252.245315640g/mol
  • Monoisotopic Mass: 252.245315640g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 13
  • Complexity: 206
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • XLogP3: 7.2
  • Topological Polar Surface Area: 17.1?2
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