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CAS 198835-05-1

:

rel-1,1-Dimethylethyl (1R,4S,6S)-6-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate

Description:
Rel-1,1-Dimethylethyl (1R,4S,6S)-6-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate, with CAS number 198835-05-1, is a chemical compound characterized by its bicyclic structure, which includes a nitrogen atom within a seven-membered ring. This compound features a hydroxyl group (-OH) and a carboxylate group (-COO-) that contribute to its reactivity and potential biological activity. The presence of the dimethyl group enhances its steric properties, influencing its interactions with biological targets. The specific stereochemistry indicated by the (1R,4S,6S) configuration suggests that the compound may exhibit unique pharmacological properties, making it of interest in medicinal chemistry. Its structural features may allow for specific binding interactions with receptors or enzymes, potentially leading to therapeutic applications. Additionally, the compound's solubility, stability, and reactivity can be influenced by its functional groups and overall molecular conformation, which are critical for its behavior in biological systems and during synthesis.
Formula:C11H19NO3
InChI:InChI=1/C11H19NO3/c1-11(2,3)15-10(14)12-6-7-4-8(12)9(13)5-7/h7-9,13H,4-6H2,1-3H3/t7-,8+,9-/s2
InChI key:InChIKey=PABFVGKPNHVSCG-DSYSRCFZNA-N
SMILES:C(OC(C)(C)C)(=O)N1[C@@]2([C@H](O)C[C@](C1)(C2)[H])[H]
Synonyms:
  • 2-Azabicyclo[2.2.1]heptane-2-carboxylic acid, 6-hydroxy-, 1,1-dimethylethyl ester, (1R,4S,6S)-rel-
  • rel-1,1-Dimethylethyl (1R,4S,6S)-6-hydroxy-2-azabicyclo[2.2.1]heptane-2-carboxylate
  • 2-Azabicyclo[2.2.1]heptane-2-carboxylic acid, 6-hydroxy-, 1,1-dimethylethyl ester, endo-
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