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CS-W001157 4
Total: USD 88.00

3'-Bromoacetophenone

  • CAS No. 2142-63-4

  • Cat. No. CS-W009131
  • Purity≥98%
  • MDL No.MFCD00000083

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

3'-Bromoacetophenone|CS-W009131

Structure of 2142-63-4

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General Information

  • CAS No. 2142-63-4
  • Cat. No. CS-W009131
  • Purity ≥98%
  • MDL No. MFCD00000083
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇BrO
  • Molecular Weight 199.05
  • Synonym(s) m-Bromoacetophenone; m-Bromophenyl methyl ketone; Ethanone, 1-(3-Bromophenyl)-
  • SMILES CC(C1=CC=CC(Br)=C1)=O

Description

3'-Bromoacetophenone features a brominated aryl ring coupled to a ketone functional group, enabling direct incorporation into cross-coupling and electrophilic substitution reactions. This bench-stable compound serves as a key intermediate in synthesizing bioactive molecules and advanced materials.

Application

3'-Bromoacetophenone serves as a versatile building block in cross-coupling reactions and heterocycle synthesis, offering reliable functional group tolerance and bench stability. Its bromo substituent enables palladium-catalyzed coupling with boronic acids or amines, while the ketone moiety supports enolization, nucleophilic addition, and subsequent derivatization. This compound facilitates efficient access to substituted biaryl and aryl ketone scaffolds commonly found in medicinal chemistry campaigns.

Synthesis

  • Route1

    References

    • Chemistry - A European Journal, , vol. 18, # 37 p. 11550 - 11554
  • Route2

    References

    • Journal of Organic Chemistry, , vol. 53, # 23 p. 5545 - 5547
  • Route3

    References

    • Organic Letters, , vol. 7, # 21 p. 4549 - 4552

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS05
Signal Word : Danger
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H317-H318
Precautionary Statements : P280-P261-P264-P305+P351+P338-P310-P302+P352-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.6517
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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