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CAS 914637-39-1

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2-Iodo-6-(trifluoromethyl)benzoic acid

Description:
2-Iodo-6-(trifluoromethyl)benzoic acid is an aromatic carboxylic acid characterized by the presence of an iodo substituent and a trifluoromethyl group on the benzene ring. The iodo group, located at the second position, enhances the compound's reactivity and can influence its electronic properties, while the trifluoromethyl group at the sixth position significantly increases the lipophilicity and stability of the molecule. This compound is typically used in organic synthesis and medicinal chemistry, often serving as an intermediate in the preparation of various pharmaceuticals and agrochemicals. Its unique functional groups contribute to its potential applications in developing compounds with specific biological activities. Additionally, the presence of both halogen substituents can affect the compound's solubility, boiling point, and overall chemical behavior, making it a subject of interest in studies related to structure-activity relationships. Safety and handling precautions should be observed due to the potential hazards associated with halogenated compounds.
Formula:C8H4F3IO2
InChI:InChI=1S/C8H4F3IO2/c9-8(10,11)4-2-1-3-5(12)6(4)7(13)14/h1-3H,(H,13,14)
InChI key:InChIKey=QIWGTWGTMFLVAQ-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=C(C(F)(F)F)C=CC=C1I
Synonyms:
  • Benzoic acid, 2-iodo-6-(trifluoromethyl)-
  • 2-Iodo-6-(trifluoromethyl)benzoic acid
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