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CS-W001157 4
Total: USD 88.00

4-Bromo-2,6-difluorobenzaldehyde

  • CAS No. 537013-51-7

  • Cat. No. CS-W009150
  • Purity≥98%
  • MDL No.MFCD03094459

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

4-Bromo-2,6-difluorobenzaldehyde|CS-W009150

Structure of 537013-51-7

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General Information

  • CAS No. 537013-51-7
  • Cat. No. CS-W009150
  • Purity ≥98%
  • MDL No. MFCD03094459
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₃BrF₂O
  • Molecular Weight 221.00
  • Synonym(s) None
  • SMILES O=CC1=C(F)C=C(Br)C=C1F

Description

4-Bromo-2,6-difluorobenzaldehyde features a trifunctional aromatic core with orthogonal reactivity: the aldehyde group enables direct coupling or functionalization, while the bromine and two fluorine substituents provide distinct sites for cross-coupling or electrophilic substitution. This electron-deficient scaffold delivers high stability under standard bench conditions and integrates readily into complex molecular architectures.

Application

4-Bromo-2,6-difluorobenzaldehyde serves as a versatile building block in medicinal chemistry and agrochemical synthesis. Its ortho-fluoro substitution enhances metabolic stability, while the bromo group enables palladium-catalyzed cross-coupling reactions. The aldehyde functionality facilitates imine formation, reductive amination, and heterocycle construction. This compound exhibits excellent bench stability and is compatible with diverse reaction conditions, making it ideal for iterative synthetic strategies in API development.

Synthesis

  • Route1
    • null|null
      461-96-1
    • null|null
      68-12-2
    • ~69%
    • In-stock
      4-Bromo-2,6-difluorobenzaldehyde|CS-W009150
      537013-51-7

    References

    • PFIZER PRODUCTS INC. Patent: WO2007/49123 A1, 2007 ; Location in patent: Page/Page column 69-70 ; WO 2007/049123 A1
  • Route2

    References

    • SAREUM LIMITED Patent: WO2008/139161 A1, 2008 ; Location in patent: Page/Page column 82-83 ; WO 2008/139161 A1
  • Route3
    • In-stock
      Piperidine-1-carbaldehyde|CS-W016610
      2591-86-8
    • null|null
      461-96-1
    • ~78%
    • In-stock
      4-Bromo-2,6-difluorobenzaldehyde|CS-W009150
      537013-51-7

    References

    • Merck Patent GmbH Patent: US2004/6235 A1, 2004 ; Location in patent: Page 11 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.5398
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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