Cas no 68892-13-7 (1-Phenyldecane-1,3-dione)

1-Phenyldecane-1,3-dione structure
1-Phenyldecane-1,3-dione structure
Product Name:1-Phenyldecane-1,3-dione
CAS No:68892-13-7
MF:C16H22O2
MW:246.344685077667
CID:58885
PubChem ID:111696
Update Time:2025-04-18

1-Phenyldecane-1,3-dione Chemical and Physical Properties

Names and Identifiers

    • 1-Phenyldecane-1,3-dione
    • 1,3-Decanedione, 1-phenyl-
    • 1-Phenyl-3-heptyl-1,3-propanedione
    • 1-Phenyldecane-1,3-dione1-n-heptyl-3-Phenyl-1,3-propanedione
    • Octanoyl-benzoyl methane
    • Rhodiastab 92
    • 1-Phenyl-1,3-decanedione
    • Benzoyl(octanoyl)methane
    • 1,3-Decanedione,1-phenyl-
    • SCHEMBL98359
    • IFQULAPKPYIHBS-UHFFFAOYSA-N
    • A836282
    • EINECS 272-599-9
    • NS00020022
    • 1(phenyl)-1,3decanedione
    • 68892-13-7
    • BETA-PHENYL CINNAMALDEHYDE
    • DTXSID7071810
    • G71327
    • Inchi: 1S/C16H22O2/c1-2-3-4-5-9-12-15(17)13-16(18)14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3
    • InChI Key: IFQULAPKPYIHBS-UHFFFAOYSA-N
    • SMILES: O=C(CC(C1C=CC=CC=1)=O)CCCCCCC

Computed Properties

  • Exact Mass: 246.16206
  • Monoisotopic Mass: 246.162
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 9
  • Complexity: 252
  • 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
  • Topological Polar Surface Area: 34.1A^2
  • Surface Charge: 0
  • Tautomer Count: 5
  • XLogP3: 4.5

Experimental Properties

  • Density: 0.984
  • Boiling Point: 357.2 °C at 760 mmHg
  • Flash Point: 134 °C
  • PSA: 34.14
  • LogP: 4.18900

1-Phenyldecane-1,3-dione Pricemore >>

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