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CS-W001157 4
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1-(4-Bromo-2,5-difluorophenyl)ethan-1-one

  • CAS No. 123942-11-0

  • Cat. No. CS-0443212
  • Purity≥98%
  • MDL No.None

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

1-(4-Bromo-2,5-difluorophenyl)ethan-1-one|CS-0443212

Structure of 123942-11-0

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General Information

  • CAS No. 123942-11-0
  • Cat. No. CS-0443212
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅BrF₂O
  • Molecular Weight 235.03
  • Synonym(s) 1-(4-Bromo-2,5-difluorophenyl)ethanone
  • SMILES CC(=O)C1=C(C=C(C(=C1)F)Br)F

Synthesis

  • Route1

    References

    • WO2013/74641 A1, ; Paragraph 00367 ;
  • Route2
    • In-stock
      2-Bromo-1,4-difluorobenzene|CS-D1221
      399-94-0
    • null|null
      75-36-5
    • ~77%
    • In-stock
      1-(4-Bromo-2,5-difluorophenyl)ethan-1-one|CS-0443212
      123942-11-0

    References

    • Journal of Medicinal Chemistry, , vol. 38, # 14 p. 2531 - 2540

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.9299
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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