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CAS 1311254-56-4

:

1,1-Dimethylethyl 1,3-dihydro-4-(hydroxymethyl)-2H-isoindole-2-carboxylate

Description:
1,1-Dimethylethyl 1,3-dihydro-4-(hydroxymethyl)-2H-isoindole-2-carboxylate, identified by its CAS number 1311254-56-4, is a chemical compound that features a complex structure typical of isoindole derivatives. This substance is characterized by the presence of a dimethyl group attached to a tertiary carbon, which contributes to its steric hindrance and potentially influences its reactivity and solubility. The hydroxymethyl group indicates the presence of a functional alcohol, which may participate in hydrogen bonding, enhancing its solubility in polar solvents. The carboxylate moiety suggests that the compound can act as an acid, capable of forming salts or participating in esterification reactions. Its isoindole core provides a framework that may exhibit interesting electronic properties, making it a candidate for various applications in organic synthesis or medicinal chemistry. Overall, the combination of these functional groups and structural features suggests potential utility in pharmaceutical development or as a building block in organic synthesis.
Formula:C14H19NO3
InChI:InChI=1S/C14H19NO3/c1-14(2,3)18-13(17)15-7-10-5-4-6-11(9-16)12(10)8-15/h4-6,16H,7-9H2,1-3H3
InChI key:InChIKey=IJGSOTXYAMVQSV-UHFFFAOYSA-N
SMILES:C(O)C1=C2C(CN(C(OC(C)(C)C)=O)C2)=CC=C1
Synonyms:
  • 1,1-Dimethylethyl 1,3-dihydro-4-(hydroxymethyl)-2H-isoindole-2-carboxylate
  • 2H-Isoindole-2-carboxylic acid, 1,3-dihydro-4-(hydroxymethyl)-, 1,1-dimethylethyl ester
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