Cas no 28982-40-3 (Octadecadienal)

Octadecadienal structure
Octadecadienal structure
Product Name:Octadecadienal
CAS No:28982-40-3
MF:C18H32O
MW:264.446085929871
CID:1438144
PubChem ID:53639820
Update Time:2025-04-20

Octadecadienal Chemical and Physical Properties

Names and Identifiers

    • Octadecadienal
    • octadeca-2,4-dienal
    • 28982-40-3
    • NXRVLIATOKLQBL-UHFFFAOYSA-N
    • DTXSID30705591
    • Inchi: 1S/C18H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h14-18H,2-13H2,1H3
    • InChI Key: NXRVLIATOKLQBL-UHFFFAOYSA-N
    • SMILES: O=CC=CC=CCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 264.24546
  • Monoisotopic Mass: 264.245315640g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 14
  • Complexity: 228
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 2
  • XLogP3: 7.6
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07

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