Cas no 1806380-96-0 (1-(4-Bromo-3-ethylphenyl)propan-2-one)

1-(4-Bromo-3-ethylphenyl)propan-2-one is a brominated aromatic ketone with a molecular formula of C??H??BrO. This compound features a propan-2-one moiety attached to a 4-bromo-3-ethylphenyl group, making it a versatile intermediate in organic synthesis. Its distinct structure allows for selective functionalization, particularly in pharmaceutical and agrochemical applications. The presence of both bromine and ethyl substituents enhances its reactivity in cross-coupling reactions, such as Suzuki or Heck couplings, facilitating the synthesis of complex aromatic systems. The compound’s stability under standard conditions and well-defined reactivity profile make it a valuable building block for researchers developing novel bioactive molecules or advanced materials.
1-(4-Bromo-3-ethylphenyl)propan-2-one structure
1806380-96-0 structure
Product Name:1-(4-Bromo-3-ethylphenyl)propan-2-one
CAS No:1806380-96-0
MF:C11H13BrO
MW:241.124322652817
CID:4792350
Update Time:2025-10-22

1-(4-Bromo-3-ethylphenyl)propan-2-one Chemical and Physical Properties

Names and Identifiers

    • 1-(4-Bromo-3-ethylphenyl)propan-2-one
    • Inchi: 1S/C11H13BrO/c1-3-10-7-9(6-8(2)13)4-5-11(10)12/h4-5,7H,3,6H2,1-2H3
    • InChI Key: VZZSXROZXHDOGH-UHFFFAOYSA-N
    • SMILES: BrC1=CC=C(CC(C)=O)C=C1CC

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 179
  • XLogP3: 3
  • Topological Polar Surface Area: 17.1

1-(4-Bromo-3-ethylphenyl)propan-2-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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A013014705-250mg
1-(4-Bromo-3-ethylphenyl)propan-2-one
1806380-96-0 97%
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489.60 USD 2021-05-31
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