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CAS 101004-93-7

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1,3-Dihydro-α-(1-methylethyl)-1-oxo-2H-isoindole-2-acetic acid

Description:
1,3-Dihydro-α-(1-methylethyl)-1-oxo-2H-isoindole-2-acetic acid, with CAS number 101004-93-7, is a chemical compound that belongs to the class of isoindole derivatives. This substance features a bicyclic structure that includes an isoindole moiety, which is characterized by a fused benzene and pyrrole ring. The presence of a ketone group (1-oxo) and an acetic acid functional group contributes to its reactivity and potential biological activity. The compound is likely to exhibit moderate solubility in organic solvents due to its hydrophobic isoindole structure, while the acetic acid portion may enhance its solubility in polar solvents. Its unique structure suggests potential applications in medicinal chemistry, possibly as a precursor or intermediate in the synthesis of pharmaceuticals. Additionally, the presence of the isopropyl group (1-methylethyl) may influence its steric properties and biological interactions. Overall, this compound represents a fascinating area of study for researchers interested in organic synthesis and drug development.
Formula:C13H15NO3
InChI:InChI=1S/C13H15NO3/c1-8(2)11(13(16)17)14-7-9-5-3-4-6-10(9)12(14)15/h3-6,8,11H,7H2,1-2H3,(H,16,17)
InChI key:InChIKey=JULAETYRRYJIAR-UHFFFAOYSA-N
SMILES:C(C(C)C)(C(O)=O)N1C(=O)C=2C(C1)=CC=CC2
Synonyms:
  • 1,3-Dihydro-α-(1-methylethyl)-1-oxo-2H-isoindole-2-acetic acid
  • 3-Methyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid
  • 2H-Isoindole-2-acetic acid, 1,3-dihydro-α-(1-methylethyl)-1-oxo-
  • 3-Methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)butanoic acid
  • 3-Methyl-2-(1-oxoisoindolin-2-yl)butanoic acid
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