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CAS 1858240-23-9

:

2-(1,3-Dihydro-1-oxo-2H-isoindol-2-yl)-3-methylbenzoic acid

Description:
2-(1,3-Dihydro-1-oxo-2H-isoindol-2-yl)-3-methylbenzoic acid is a chemical compound characterized by its complex structure, which includes an isoindole moiety and a benzoic acid functional group. This compound typically exhibits properties associated with both aromatic and heterocyclic compounds, such as stability and potential for various chemical reactions. The presence of the carboxylic acid group (-COOH) suggests that it can participate in acid-base reactions, while the isoindole structure may contribute to its biological activity and potential as a pharmaceutical agent. The compound's molecular interactions may be influenced by hydrogen bonding and π-π stacking due to its aromatic nature. Additionally, its solubility and reactivity can vary depending on the solvent and environmental conditions. Overall, this compound may have applications in medicinal chemistry, particularly in the development of new therapeutic agents, owing to its unique structural features and potential biological activities.
Formula:C16H13NO3
InChI:InChI=1S/C16H13NO3/c1-10-5-4-8-13(16(19)20)14(10)17-9-11-6-2-3-7-12(11)15(17)18/h2-8H,9H2,1H3,(H,19,20)
InChI key:InChIKey=IYIFUJHPSHXNGH-UHFFFAOYSA-N
SMILES:O=C1N(CC=2C1=CC=CC2)C3=C(C(O)=O)C=CC=C3C
Synonyms:
  • 2-(1,3-Dihydro-1-oxo-2H-isoindol-2-yl)-3-methylbenzoic acid
  • Benzoic acid, 2-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-3-methyl-
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