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CAS 52548-14-8

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2-Iodo-5-methylbenzoic acid

Description:
2-Iodo-5-methylbenzoic acid is an aromatic carboxylic acid characterized by the presence of an iodine atom and a methyl group on a benzoic acid framework. The iodine substituent is located at the second position, while the methyl group is at the fifth position of the benzene ring, which influences its chemical reactivity and physical properties. This compound typically appears as a white to off-white solid and is sparingly soluble in water but more soluble in organic solvents such as ethanol and acetone. Its molecular structure contributes to its potential applications in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. The presence of the iodine atom can enhance the compound's reactivity in nucleophilic substitution reactions, while the carboxylic acid functional group allows for acid-base reactions and the formation of esters. Additionally, 2-Iodo-5-methylbenzoic acid can serve as a useful intermediate in various chemical transformations, making it a valuable compound in synthetic organic chemistry.
Formula:C8H7IO2
InChI:InChI=1S/C8H7IO2/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11)
InChI key:InChIKey=INGWGCDYAJKXKP-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=C(I)C=CC(C)=C1
Synonyms:
  • 5-Methyl-2-iodobenzoic acid
  • Benzoic acid, 2-iodo-5-methyl-
  • 2-Iodo-5-methylbenzoic acid
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