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CAS 7394-79-8

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5-Methyl-1H-indole-3-propanoic acid

Description:
5-Methyl-1H-indole-3-propanoic acid, with the CAS number 7394-79-8, is an organic compound that belongs to the indole family, characterized by its bicyclic structure containing a fused benzene and pyrrole ring. This compound features a propanoic acid side chain at the 3-position and a methyl group at the 5-position of the indole ring. It is typically a white to off-white solid and is soluble in organic solvents, with limited solubility in water. The presence of the carboxylic acid group contributes to its acidic properties, making it a weak acid. This compound is of interest in various fields, including medicinal chemistry and biochemistry, due to its potential biological activities, such as influencing neurotransmitter systems or serving as a precursor in the synthesis of other bioactive molecules. Its structural characteristics allow for various chemical modifications, which can enhance its pharmacological properties. As with many indole derivatives, it may exhibit a range of biological activities, warranting further investigation for potential therapeutic applications.
Formula:C12H13NO2
InChI:InChI=1S/C12H13NO2/c1-8-2-4-11-10(6-8)9(7-13-11)3-5-12(14)15/h2,4,6-7,13H,3,5H2,1H3,(H,14,15)
InChI key:InChIKey=AKIUYHHBFACIEZ-UHFFFAOYSA-N
SMILES:C(CC(O)=O)C=1C=2C(NC1)=CC=C(C)C2
Synonyms:
  • 5-Methyl-1H-indole-3-propanoic acid
  • 3-(5-Methyl-1H-indol-3-yl)propanoic acid
  • 1H-Indole-3-propanoic acid, 5-methyl-
  • Indole-3-propionic acid, 5-methyl-
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