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CAS 1385694-53-0

:

1-(3-Bromophenyl)-4-oxocyclohexanecarboxylic acid

Description:
1-(3-Bromophenyl)-4-oxocyclohexanecarboxylic acid is an organic compound characterized by its unique structure, which includes a cyclohexane ring, a carboxylic acid functional group, and a bromophenyl substituent. The presence of the bromine atom on the phenyl ring contributes to its reactivity and potential applications in various chemical reactions, such as electrophilic aromatic substitution. The ketone group (4-oxo) enhances the compound's ability to participate in condensation reactions and can influence its acidity and solubility properties. This compound may exhibit biological activity, making it of interest in medicinal chemistry and drug development. Its molecular structure suggests potential for interactions with biological targets, which could be explored in pharmacological studies. Additionally, the compound's physical properties, such as melting point, boiling point, and solubility, would be influenced by the functional groups present and the overall molecular geometry. As with many organic compounds, safety and handling precautions should be observed due to the presence of bromine and the potential for toxicity.
Formula:C13H13BrO3
InChI:InChI=1S/C13H13BrO3/c14-10-3-1-2-9(8-10)13(12(16)17)6-4-11(15)5-7-13/h1-3,8H,4-7H2,(H,16,17)
InChI key:InChIKey=UCHFVVKRPFIJHT-UHFFFAOYSA-N
SMILES:C(O)(=O)C1(CCC(=O)CC1)C2=CC(Br)=CC=C2
Synonyms:
  • Cyclohexanecarboxylic acid, 1-(3-bromophenyl)-4-oxo-
  • 1-(3-Bromophenyl)-4-oxocyclohexanecarboxylic acid
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