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Atomfair 4-Bromo-2,6-difluorobenzoic acid C7H3BrF2O2 CAS 183065-68-1

4-Bromo-2,6-difluorobenzoic acid (CAS No. 183065-68-1) is a high-purity fluorinated benzoic acid derivative with the molecular formula C7H3BrF2O2. This compound is a valuable building block in organic synthesis, particularly in pharmaceutical and agrochemical research. Its unique bromo- and difluoro-substituted aromatic structure makes it ideal for cross-coupling reactions, such as Suzuki-Miyaura or Buchwald-Hartwig couplings, enabling the introduction of complex functionalities. With a purity of ≥97%, this reagent is supplied as a white to off-white crystalline powder, ensuring consistent performance in demanding applications. It is stored under inert conditions to maintain stability and is compatible with a wide range of solvents, including DMF,…

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Description

4-Bromo-2,6-difluorobenzoic acid (CAS No. 183065-68-1) is a high-purity fluorinated benzoic acid derivative with the molecular formula C7H3BrF2O2. This compound is a valuable building block in organic synthesis, particularly in pharmaceutical and agrochemical research. Its unique bromo- and difluoro-substituted aromatic structure makes it ideal for cross-coupling reactions, such as Suzuki-Miyaura or Buchwald-Hartwig couplings, enabling the introduction of complex functionalities. With a purity of ≥97%, this reagent is supplied as a white to off-white crystalline powder, ensuring consistent performance in demanding applications. It is stored under inert conditions to maintain stability and is compatible with a wide range of solvents, including DMF, THF, and dichloromethane. Suitable for researchers requiring precision in medicinal chemistry, material science, and ligand design.

Properties

  • CAS Number: 183065-68-1
  • Complexity: 176
  • IUPAC Name: 4-bromo-2,6-difluoro-benzoic acid
  • InChI: InChI=1S/C7H3BrF2O2/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H,11,12)
  • InChI Key: IRHPJGPQWZEZRX-UHFFFAOYSA-N
  • Exact Mass: 235.92845
  • Molecular Formula: C7H3BrF2O2
  • Molecular Weight: 237.00
  • SMILES: C1=C(C=C(C(=C1F)C(=O)O)F)Br
  • Topological: 37.3
  • Monoisotopic Mass: 235.92845
  • Synonyms: 4-Bromo-2,6-difluorobenzoic Acid, 183065-68-1, DTXSID80378350, DTXCID30329377, 457-940-3, 605-988-2, BENZOIC ACID, 4-BROMO-2,6-DIFLUORO-, MFCD03094085, 4-bromo-2,6-difluoro-benzoic Acid, 2,6-Difluoro-4-bromobenzoic acid, SCHEMBL516974, SBB052760, AKOS005063384, AC-1684, CS-W009173, FB69968, 4-Bromo-2,6-difluorobenzoic acid, 97%, AS-17828, SY014292, DB-005331, B3447, NS00007679, 4-Bromo-2,6-difluoro-benzene carboxylic acid, EN300-99516, Z1269138265

4-Bromo-2,6-difluorobenzoic acid serves as a versatile intermediate in the synthesis of bioactive molecules, including kinase inhibitors and antimicrobial agents. Its electron-deficient aromatic ring facilitates nucleophilic substitution reactions, making it useful for constructing fluorinated heterocycles. In material science, it acts as a precursor for liquid crystals and OLED materials due to its rigid, halogenated core. The compound is also employed in labeling and tracer studies for metabolic research.

Safety and Hazards

GHS Hazard Statements

  • H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
  • H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

Precautionary Statements

  • P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

Hazard Classes and Categories

  • Acute Tox. 4 (81.2%)
  • Skin Irrit. 2 (16.7%)
  • Eye Irrit. 2A (97.9%)
  • STOT SE 3 (16.7%)

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.

Disclaimer

Intended Use & Restrictions

This product is sold exclusively for laboratory research, analytical testing, or non-commercial purposes.

  • Strictly prohibited: Resale, repackaging, or formulation into commercial products.
  • Not approved for human/animal use, diagnostics, or manufacturing (including pharmaceuticals, agrochemicals, or consumer goods).

Patent & Regulatory Compliance

Certain molecules may be protected by active patents or regulatory restrictions.

  • Buyers must independently verify patent status (e.g., via USPTO/EPO/CNIPA) and comply with local laws.
  • Atomfair LLC does not provide legal assurances regarding patent non-infringement or jurisdictional compliance.

Liability Release

By purchasing, the buyer agrees to:

  • Use this product only as permitted by law.
  • Indemnify Atomfair LLC against all claims arising from misuse, patent infringement, or regulatory violations.

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