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CAS 1523571-08-5

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2,6-Diazaspiro[3.5]nonane-2-carboxylic acid, 1,1-dimethylethyl ester, ethanedioate (2:1)

Description:
2,6-Diazaspiro[3.5]nonane-2-carboxylic acid, 1,1-dimethylethyl ester, ethanedioate (2:1) is a complex organic compound characterized by its unique spirocyclic structure, which incorporates nitrogen atoms within a bicyclic framework. This compound features a carboxylic acid derivative, indicating the presence of a carboxyl functional group, and an ester functionality due to the tert-butyl ester moiety. The presence of the ethanedioate component suggests that it forms a salt or complex with ethylene dicarboxylic acid, enhancing its solubility and reactivity. The spiro structure contributes to its rigidity and may influence its biological activity, making it of interest in medicinal chemistry. Additionally, the compound's nitrogen atoms can participate in hydrogen bonding and coordination with metal ions, potentially affecting its chemical behavior and interactions. Overall, this compound's unique structural features and functional groups suggest potential applications in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. However, specific properties such as solubility, melting point, and reactivity would require empirical data for precise characterization.
Formula:C12H22N2O2C2H2O4
InChI:InChI=1S/C12H22N2O2.C2H2O4/c1-11(2,3)16-10(15)14-8-12(9-14)5-4-6-13-7-12;3-1(4)2(5)6/h13H,4-9H2,1-3H3;(H,3,4)(H,5,6)
InChI key:InChIKey=NBFMPKLFGBQTIS-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CC2(C1)CCCNC2.C(C(O)=O)(O)=O
Synonyms:
  • 2,6-Diazaspiro[3.5]nonane-2-carboxylic acid, 1,1-dimethylethyl ester, ethanedioate (2:1)
  • tert-Butyl 2,6-diazaspiro[3.5]nonane-2-carboxylate hemioxalate
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