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CS-W001157 4
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2-Bromo-1-(2-chlorophenyl)ethan-1-one

  • CAS No. 5000-66-8

  • Cat. No. CS-0008415
  • Molecule weight233.49
  • Purity≥85%
  • MDL No.MFCD00832993

*For research and further manufacturing use only, not for direct human use.

2-Bromo-1-(2-chlorophenyl)ethan-1-one|CS-0008415

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General Information

  • CAS No. 5000-66-8
  • Cat. No. CS-0008415
  • Purity ≥85%
  • MDL No. MFCD00832993
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆BrClO
  • Molecular Weight 233.49
  • Synonym(s) 2-Chloro-2'-bromoacetophenone
  • SMILES ClC1=CC=CC=C1C(CBr)=O

Description

2-Bromo-1-(2-chlorophenyl)ethan-1-one features a brominated ketone moiety flanked by a chlorinated aromatic ring, enabling direct incorporation into cross-coupling and heterocycle-forming reactions. This bench-stable compound serves as a key building block for pharmaceutical intermediates and functional materials, where its halogenated aryl and reactive carbonyl groups facilitate selective transformations under standard conditions.

Application

2-Bromo-1-(2-chlorophenyl)ethan-1-one serves as a versatile building block in synthetic organic chemistry, enabling efficient construction of biaryl and heterocyclic scaffolds. Its bromo and chlorophenyl functionalities support palladium-catalyzed cross-coupling reactions and facilitate electrophilic substitution patterns. The compound exhibits bench stability and compatibility with standard purification methods, making it suitable for iterative synthesis workflows in medicinal chemistry and process development.

Synthesis

  • Route1
    • null|null
      2142-68-9
    • ~81%
    • In-stock
      2-Bromo-1-(2-chlorophenyl)ethan-1-one|CS-0008415
      5000-66-8

    References

    • Denny, William Alexander; Hutchings, Richard H; Johnson, Douglas S; Kaltenbronn, James Stanely; Lee, Ho Huat; Leonard, Daniele Marie; Milbank, Jared Bruce John; Repine, Joseph Thomas; Rewcastle, Gordon William; White, Andrew David Patent: US2004/44057 A1, 2004 ;
  • Route2
    • null|null
      1056775-36-0
    • ~83%
    • In-stock
      2-Bromo-1-(2-chlorophenyl)ethan-1-one|CS-0008415
      5000-66-8

    References

    • Chen, Zheng-Wang; Ye, Dong-Nai; Ye, Min; Zhou, Zhong-Gao; Li, Shen-Huan; Liu, Liang-Xian Tetrahedron Letters, 2014 , vol. 55, # 7 p. 1373 - 1375
  • Route3
    • null|null
      2142-68-9
    • ~%
    • 2,2-Dibromo-1-(2-chlorophenyl)ethanone|CS-0754777
      34356-83-7
    • In-stock
      2-Bromo-1-(2-chlorophenyl)ethan-1-one|CS-0008415
      5000-66-8

    References

    • Kumar, Sunil; Gawandi, Vijay B.; Capito, Nicholas; Phillips, Robert S. Biochemistry, 2010 , vol. 49, # 36 p. 7913 - 7919

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 2922
Class : 8,6.1
Packing Group : Ⅱ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.9176
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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