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CAS 1449117-36-5

:

1,1-Dimethylethyl 9-azabicyclo[3.3.1]nona-2,6-diene-9-carboxylate

Description:
1,1-Dimethylethyl 9-azabicyclo[3.3.1]nona-2,6-diene-9-carboxylate, identified by its CAS number 1449117-36-5, is a chemical compound characterized by its bicyclic structure, which includes a nitrogen atom in the ring system. This compound features a carboxylate functional group, contributing to its potential reactivity and solubility properties. The presence of the dimethyl group indicates steric hindrance, which can influence its chemical behavior and interactions with other molecules. The bicyclic framework suggests that it may exhibit unique conformational characteristics, potentially affecting its biological activity. Such compounds are often of interest in medicinal chemistry due to their structural complexity and potential pharmacological properties. Additionally, the azabicyclic structure may impart specific electronic properties, making it suitable for various applications in organic synthesis or as a building block in drug development. Overall, the compound's unique structural features and functional groups make it a subject of interest for further research in both synthetic and medicinal chemistry.
Formula:C13H19NO2
InChI:InChI=1S/C13H19NO2/c1-13(2,3)16-12(15)14-10-6-4-7-11(14)9-5-8-10/h4-6,9-11H,7-8H2,1-3H3
InChI key:InChIKey=HYCXKXFMPAFVIZ-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C2CC=CC1CC=C2
Synonyms:
  • 9-Azabicyclo[3.3.1]nona-2,6-diene-9-carboxylic acid, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 9-azabicyclo[3.3.1]nona-2,6-diene-9-carboxylate
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