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CS-W001157 4
Total: USD 88.00

3-Bromo-6-chloro-2-fluorobenzaldehyde

  • CAS No. 886615-30-1

  • Cat. No. CS-0115587
  • Purity≥96%
  • MDL No.MFCD11111905

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

3-Bromo-6-chloro-2-fluorobenzaldehyde|CS-0115587

Structure of 886615-30-1

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General Information

  • CAS No. 886615-30-1
  • Cat. No. CS-0115587
  • Purity ≥96%
  • MDL No. MFCD11111905
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₃BrClFO
  • Molecular Weight 237.45
  • Synonym(s) 3-bromo-6-chloro-2-fluoro-benzaldehyde
  • SMILES O=CC1=C(Cl)C=CC(Br)=C1F

Description

3-Bromo-6-chloro-2-fluorobenzaldehyde features a trihalogenated aromatic core with strategically positioned bromo, chloro, and fluoro substituents that modulate electronic properties and reactivity. This electron-deficient aldehyde integrates readily into cross-coupling cascades and serves as a key building block for functionalized heterocycles in medicinal chemistry and materials synthesis.

Application

3-Bromo-6-chloro-2-fluorobenzaldehyde serves as a versatile electrophilic building block in medicinal chemistry and agrochemical synthesis. Its orthogonal halogenation pattern enables sequential cross-coupling reactions, including Suzuki-Miyaura and Buchwald-Hartwig transformations, with high functional group tolerance. The aldehyde functionality facilitates direct derivatization via reductive amination or Grignard addition. Bench-stable and readily purified by flash chromatography, it functions reliably in multi-step syntheses of complex heterocyclic scaffolds and bioactive molecules.

Synthesis

  • Route1
    • null|null
      68-12-2
    • ~49%
    • In-stock
      3-Bromo-6-chloro-2-fluorobenzaldehyde|CS-0115587
      886615-30-1

    References

    • ELI LILLY AND COMPANY Patent: WO2006/49952 A1, 2006 ; Location in patent: Page/Page column 53 ;
  • Route2
    • In-stock
      4-Chloro-2-fluorobromobenzene|CS-W008703
      1996-29-8
    • null|null
      68-12-2
    • ~%
    • In-stock
      3-Bromo-6-chloro-2-fluorobenzaldehyde|CS-0115587
      886615-30-1

    References

    • DOW AGROSCIENCES LLC Patent: WO2007/82076 A1, 2007 ; Location in patent: Page/Page column 28 ;

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

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.0541
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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