Cas no 13152-95-9 ((2,4-dimethylphenyl)(3-methylphenyl)methanone)

(2,4-dimethylphenyl)(3-methylphenyl)methanone structure
13152-95-9 structure
Product Name:(2,4-dimethylphenyl)(3-methylphenyl)methanone
CAS No:13152-95-9
MF:C16H16O
MW:224.297644615173
CID:898676
PubChem ID:349077
Update Time:2025-04-19

(2,4-dimethylphenyl)(3-methylphenyl)methanone Chemical and Physical Properties

Names and Identifiers

    • (2,4-dimethylphenyl)(3-methylphenyl)methanone
    • (2,4-dimethylphenyl)-(3-methylphenyl)methanone
    • Inchi: 1S/C16H16O/c1-11-5-4-6-14(10-11)16(17)15-8-7-12(2)9-13(15)3/h4-10H,1-3H3
    • InChI Key: COCNAUUGIBCANE-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=C(C)C=1)C1C=CC(C)=CC=1C

Computed Properties

  • Exact Mass: 224.12018
  • Monoisotopic Mass: 224.120115130g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 271
  • 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: 4.4
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07

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