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CAS 791137-25-2

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3-Bromo-4,5-dichlorobenzoic acid

Description:
3-Bromo-4,5-dichlorobenzoic acid is an aromatic carboxylic acid characterized by the presence of a bromine atom and two chlorine atoms substituted on the benzene ring. This compound features a carboxylic acid functional group (-COOH), which imparts acidic properties. The presence of halogen substituents, specifically bromine and chlorine, can influence the compound's reactivity, solubility, and overall chemical behavior. Typically, such halogenated benzoic acids exhibit increased lipophilicity and may participate in various chemical reactions, including nucleophilic substitutions and electrophilic aromatic substitutions. The compound is likely to be solid at room temperature and may have moderate solubility in organic solvents, while its solubility in water can vary depending on the pH. Additionally, the presence of multiple halogens can enhance the compound's biological activity, making it of interest in pharmaceutical and agrochemical research. Safety data should be consulted for handling and disposal, as halogenated compounds can pose environmental and health risks.
Formula:C7H3BrCl2O2
InChI:InChI=1S/C7H3BrCl2O2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H,11,12)
InChI key:InChIKey=DNBQQKJUGWWBLT-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=CC(Br)=C(Cl)C(Cl)=C1
Synonyms:
  • 3-Bromo-4,5-dichlorobenzoic acid
  • Benzoic acid, 3-bromo-4,5-dichloro-
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