Cas no 35730-02-0 (1-(4-Methylphenyl)-3-phenylpropan-2-one)

1-(4-Methylphenyl)-3-phenylpropan-2-one structure
35730-02-0 structure
Product Name:1-(4-Methylphenyl)-3-phenylpropan-2-one
CAS No:35730-02-0
MF:C16H16O
MW:224.297644615173
CID:2823644
PubChem ID:12424310
Update Time:2025-04-21

1-(4-Methylphenyl)-3-phenylpropan-2-one Chemical and Physical Properties

Names and Identifiers

    • DTXSID80497616
    • 35730-02-0
    • p-methyldibenzylketone
    • DTXCID80448426
    • SCHEMBL11219229
    • 1-(4-methylphenyl)-3-phenylacetone
    • 1-(4-Methylphenyl)-3-phenylpropan-2-one
    • Inchi: 1S/C16H16O/c1-13-7-9-15(10-8-13)12-16(17)11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
    • InChI Key: KBBDOKNCFKDMBK-UHFFFAOYSA-N
    • SMILES: O=C(CC1C=CC=CC=1)CC1C=CC(C)=CC=1

Computed Properties

  • Exact Mass: 224.120115130Da
  • Monoisotopic Mass: 224.120115130Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 232
  • 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: 3.5
  • Topological Polar Surface Area: 17.1?2
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