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CAS 159877-36-8

:

1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate

Description:
1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate, identified by its CAS number 159877-36-8, is a chemical compound that belongs to the class of pyrrolidine derivatives. It features a complex bicyclic structure that includes a pyrrolidine ring fused to a pyridine ring, contributing to its unique chemical properties. The presence of the dimethyl group enhances its steric bulk, which can influence its reactivity and interactions with other molecules. This compound is typically characterized by its moderate polarity, which affects its solubility in various solvents. It may exhibit biological activity, making it of interest in medicinal chemistry and pharmacology. The ester functional group in its structure suggests potential for hydrolysis reactions, which could be relevant in biological systems. Overall, this compound's structural features and functional groups suggest it may have applications in drug development or as an intermediate in organic synthesis. However, specific properties such as melting point, boiling point, and spectral data would require empirical measurement or literature reference for precise characterization.
Formula:C12H22N2O2
InChI:InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-6-4-5-9-7-13-8-10(9)14/h9-10,13H,4-8H2,1-3H3
InChI key:InChIKey=LGEWGFOMLJQHLL-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C2C(CNC2)CCC1
Synonyms:
  • 1,1-Dimethylethyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
  • 1-Boc-Octahydropyrrolo[3,4-B]Pyridine
  • 1H-Pyrrolo[3,4-b]pyridine-1-carboxylic acid, octahydro-, 1,1-dimethylethyl ester
  • Octahydropyrrolo[3,4-b]pyridine-1-carboxylic acid tert-butyl ester
  • tert-Butyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
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