Cas no 30658-25-4 (2H-Pyran-2-one, tetrahydro-6-(4-oxopentyl)-)

2H-Pyran-2-one, tetrahydro-6-(4-oxopentyl)- structure
30658-25-4 structure
Product Name:2H-Pyran-2-one, tetrahydro-6-(4-oxopentyl)-
CAS No:30658-25-4
MF:C10H16O3
MW:184.232243537903
CID:1443786
PubChem ID:14411756
Update Time:2025-04-20

2H-Pyran-2-one, tetrahydro-6-(4-oxopentyl)- Chemical and Physical Properties

Names and Identifiers

    • 2H-Pyran-2-one, tetrahydro-6-(4-oxopentyl)-
    • Tetrahydro-6-(4-oxopentyl)-2H-pyran-2-one
    • DB-388612
    • 30658-25-4
    • SCHEMBL11854942
    • Inchi： 1S/C10H16O3/c1-8(11)4-2-5-9-6-3-7-10(12)13-9/h9H,2-7H2,1H3
    • InChI Key： WQAWFRFKWGDNIA-UHFFFAOYSA-N
    • SMILES： O1C(CCCC1CCCC(C)=O)=O

Computed Properties

  • Exact Mass: 184.10998
  • Monoisotopic Mass: 184.109944368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 198
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37

2H-Pyran-2-one, tetrahydro-6-(4-oxopentyl)- Related Literature

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