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CAS 907606-68-2

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Cyclopenta[c]pyrrole-1-carboxylic acid, octahydro-, 1,1-dimethylethyl ester, (1S,3aR,6aS)-, ethanedioate (1:1)

Description:
Cyclopenta[c]pyrrole-1-carboxylic acid, octahydro-, 1,1-dimethylethyl ester, (1S,3aR,6aS)-, ethanedioate (1:1) is a complex organic compound characterized by its unique bicyclic structure, which includes a cyclopentane and pyrrole moiety. This compound features a carboxylic acid derivative with an ester functional group, indicating it is likely to exhibit moderate polarity and solubility in organic solvents. The presence of the octahydro structure suggests that it is saturated, contributing to its stability and potentially influencing its reactivity. The stereochemistry indicated by the (1S,3aR,6aS) configuration implies specific spatial arrangements of atoms, which can affect the compound's biological activity and interactions. As an ester, it may undergo hydrolysis under acidic or basic conditions, releasing the corresponding carboxylic acid and alcohol. The ethanedioate component suggests the presence of a dicarboxylic acid moiety, which can participate in various chemical reactions, including esterification and condensation. Overall, this compound's characteristics make it of interest in synthetic organic chemistry and potential applications in pharmaceuticals or materials science.
Formula:C12H21NO2·C2H2O4
InChI:InChI=1S/C12H21NO2.C2H2O4/c1-12(2,3)15-11(14)10-9-6-4-5-8(9)7-13-10;3-1(4)2(5)6/h8-10,13H,4-7H2,1-3H3;(H,3,4)(H,5,6)/t8-,9-,10-;/m0./s1
InChI key:InChIKey=ZCTXDLWZMFBZEV-PUBMXKGKSA-N
SMILES:C(OC(C)(C)C)(=O)[C@@H]1[C@@]2([C@](CN1)(CCC2)[H])[H].C(C(O)=O)(O)=O
Synonyms:
  • (1S,3aR,6aS)-Octahydrocyclopenta[c]pyrrole-1-carboxylic acid tert-butyl ester oxalate
  • (1S,3aR,6aS)-tert-butyl octahydrocyclopenta[c]pyrrole-1-carboxylate oxalate
  • (1S,3aR,6aS)-tert-butyloctahydrocyclopenta[c]pyrrole-1-carboxylate oxalate
  • Cyclopenta[c]pyrrole-1-carboxylic acid, octahydro-, 1,1-dimethylethyl ester, (1S,3aR,6aS)-, ethanedioate (1:1)
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