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CAS 959576-35-3

:

1-(1,1-Dimethylethyl) (2S,4R)-4-[(4-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate

Description:
1-(1,1-Dimethylethyl) (2S,4R)-4-[(4-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate, with the CAS number 959576-35-3, is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring with two carboxylate groups and a tert-butyl substituent. This compound exhibits chirality due to the presence of stereocenters, specifically at the 2 and 4 positions of the pyrrolidine ring, which contributes to its potential biological activity. The presence of the 4-chlorophenylmethyl group suggests that it may interact with biological targets, making it of interest in medicinal chemistry. Its solubility and stability can vary depending on the solvent and environmental conditions, which are important for its application in research or pharmaceutical development. Additionally, the compound's functional groups may influence its reactivity and interactions with other molecules, making it a candidate for further studies in drug design or synthesis. Overall, this compound's unique structural features and potential biological implications warrant further investigation.
Formula:C17H22ClNO4
InChI:InChI=1S/C17H22ClNO4/c1-17(2,3)23-16(22)19-10-12(9-14(19)15(20)21)8-11-4-6-13(18)7-5-11/h4-7,12,14H,8-10H2,1-3H3,(H,20,21)/t12-,14+/m1/s1
InChI key:InChIKey=CYTDFJOBCYJCOQ-OCCSQVGLSA-N
SMILES:C(OC(C)(C)C)(=O)N1[C@H](C(O)=O)C[C@@H](CC2=CC=C(Cl)C=C2)C1
Synonyms:
  • (2S,4R)-1-(tert-Butoxycarbonyl)-4-(4-chlorobenzyl)pyrrolidine-2-carboxylic acid
  • 1,2-Pyrrolidinedicarboxylic acid, 4-[(4-chlorophenyl)methyl]-, 1-(1,1-dimethylethyl) ester, (2S,4R)-
  • 1-(1,1-Dimethylethyl) (2S,4R)-4-[(4-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate
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