Cas no 103931-20-0 (1-(4-Acetylphenyl)-2-methyl-1-propanone)

1-(4-Acetylphenyl)-2-methyl-1-propanone is a specialized organic compound featuring an acetylphenyl group linked to a branched ketone structure. This compound is of interest in synthetic chemistry due to its potential as an intermediate in the preparation of pharmaceuticals, agrochemicals, and fine chemicals. Its distinct molecular architecture, combining aromatic and aliphatic ketone functionalities, allows for versatile reactivity in condensation, reduction, and nucleophilic addition reactions. The presence of the acetyl group enhances its utility in further derivatization, while the branched alkyl chain may influence steric and electronic properties. Suitable for controlled laboratory use, it requires handling under standard safety protocols due to its organic nature.
1-(4-Acetylphenyl)-2-methyl-1-propanone structure
103931-20-0 structure
Product Name:1-(4-Acetylphenyl)-2-methyl-1-propanone
CAS No:103931-20-0
MF:C12H14O2
MW:190.238363742828
CID:125940
PubChem ID:15206077
Update Time:2025-11-02

1-(4-Acetylphenyl)-2-methyl-1-propanone Chemical and Physical Properties

Names and Identifiers

    • 1-(4-Acetylphenyl)-2-methyl-1-propanone
    • 4-ISOBUTYRYLACETOPHENONE
    • 1-Propanone,1-(4-acetylphenyl)-2-methyl-
    • 1-(4-acetylphenyl)-2-methylpropan-1-one
    • UNII-ZEN7L2XC8B
    • SCHEMBL9340081
    • DTXSID10569991
    • OKDVJTURSCLUBA-UHFFFAOYSA-N
    • FT-0661332
    • AKOS006284507
    • ZEN7L2XC8B
    • 103931-20-0
    • 1-Propanone, 1-(4-acetylphenyl)-2-methyl-
    • Inchi： 1S/C12H14O2/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13/h4-8H,1-3H3
    • InChI Key： OKDVJTURSCLUBA-UHFFFAOYSA-N
    • SMILES： O=C(C1C=CC(C(C)=O)=CC=1)C(C)C

Computed Properties

  • Exact Mass: 190.09900
  • Monoisotopic Mass: 190.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 223
  • 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: 2.4
  • Topological Polar Surface Area: 34.1?2

Experimental Properties

  • PSA: 34.14000
  • LogP: 2.72790

1-(4-Acetylphenyl)-2-methyl-1-propanone Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd.
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A187400-50mg
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A187400-100mg
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A187400-250mg
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A2B Chem LLC
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