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CAS 694439-03-7

:

rel-1,1-Dimethylethyl (4aR,7aS)-hexahydro-6H-1,4-dioxino[2,3-c]pyrrole-6-carboxylate

Description:
Rel-1,1-Dimethylethyl (4aR,7aS)-hexahydro-6H-1,4-dioxino[2,3-c]pyrrole-6-carboxylate, with CAS number 694439-03-7, is a chemical compound characterized by its unique bicyclic structure that incorporates a dioxin and pyrrole moiety. This compound features a hexahydro framework, indicating it is saturated and likely exhibits stability under standard conditions. The presence of the dimethylethyl group suggests that it may possess hydrophobic characteristics, influencing its solubility and interaction with biological systems. The stereochemistry, denoted by the (4aR,7aS) configuration, indicates specific spatial arrangements of atoms, which can significantly affect the compound's reactivity and biological activity. As a carboxylate ester, it may participate in various chemical reactions, including hydrolysis and esterification. The compound's potential applications could span across pharmaceuticals, agrochemicals, or materials science, depending on its biological activity and chemical properties. Further studies would be necessary to elucidate its specific interactions and potential uses in various fields.
Formula:C11H19NO4
InChI:InChI=1/C11H19NO4/c1-11(2,3)16-10(13)12-6-8-9(7-12)15-5-4-14-8/h8-9H,4-7H2,1-3H3/t8-,9+
InChI key:InChIKey=YTGMDYKVUYMIQK-DTORHVGONA-N
SMILES:C(OC(C)(C)C)(=O)N1C[C@@]2([C@](C1)(OCCO2)[H])[H]
Synonyms:
  • rel-1,1-Dimethylethyl (4aR,7aS)-hexahydro-6H-1,4-dioxino[2,3-c]pyrrole-6-carboxylate
  • 6H-1,4-Dioxino[2,3-c]pyrrole-6-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester, (4aR,7aS)-rel-
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