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CAS 170108-06-2

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2-Bromo-4-chloro-3-fluorobenzoic acid

Description:
2-Bromo-4-chloro-3-fluorobenzoic acid is an aromatic carboxylic acid characterized by the presence of three halogen substituents on its benzene ring: bromine, chlorine, and fluorine. This compound features a carboxylic acid functional group (-COOH), which imparts acidic properties and enhances its solubility in polar solvents. The presence of halogens contributes to its reactivity, influencing both electrophilic and nucleophilic substitution reactions. The specific positions of the halogens on the benzene ring (2, 4, and 3) indicate a pattern of substitution that can affect the compound's electronic properties and steric hindrance, potentially impacting its biological activity and interactions with other molecules. 2-Bromo-4-chloro-3-fluorobenzoic acid is often used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. Its unique combination of functional groups and substituents makes it a valuable compound for research in medicinal chemistry and materials science. Safety precautions should be observed when handling this compound due to its potential toxicity and reactivity.
Formula:C7H3BrClFO2
InChI:InChI=1S/C7H3BrClFO2/c8-5-3(7(11)12)1-2-4(9)6(5)10/h1-2H,(H,11,12)
InChI key:InChIKey=CPXFMJZURXTLMQ-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=C(Br)C(F)=C(Cl)C=C1
Synonyms:
  • 2-Bromo-4-chloro-3-fluorobenzoic acid
  • Benzoic acid, 2-bromo-4-chloro-3-fluoro-
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