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CAS 959576-36-4

:

1-(1,1-Dimethylethyl) (2S,4R)-4-[(3-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate

Description:
1-(1,1-Dimethylethyl) (2S,4R)-4-[(3-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate, with CAS number 959576-36-4, is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring with two carboxylate groups and a tert-butyl substituent. The compound features chirality, indicated by the (2S,4R) configuration, which suggests specific spatial arrangements of its atoms that can influence its biological activity and interactions. The presence of a 3-chlorophenyl group contributes to its hydrophobic characteristics, potentially affecting its solubility and reactivity. This compound may exhibit pharmacological properties, making it of interest in medicinal chemistry. Its synthesis and characterization would typically involve standard organic chemistry techniques, and its stability, reactivity, and potential applications would be evaluated through various analytical methods. Overall, the unique structural features of this compound suggest it could play a role in drug development or other chemical applications, although specific biological activities would require further investigation.
Formula:C17H22ClNO4
InChI:InChI=1S/C17H22ClNO4/c1-17(2,3)23-16(22)19-10-12(9-14(19)15(20)21)7-11-5-4-6-13(18)8-11/h4-6,8,12,14H,7,9-10H2,1-3H3,(H,20,21)/t12-,14+/m1/s1
InChI key:InChIKey=RAJKVFMPBMVDDC-OCCSQVGLSA-N
SMILES:C(OC(C)(C)C)(=O)N1[C@H](C(O)=O)C[C@@H](CC2=CC(Cl)=CC=C2)C1
Synonyms:
  • (2S,4R)-1-(tert-Butoxycarbonyl)-4-(3-chlorobenzyl)pyrrolidine-2-carboxylic acid
  • 1,2-Pyrrolidinedicarboxylic acid, 4-[(3-chlorophenyl)methyl]-, 1-(1,1-dimethylethyl) ester, (2S,4R)-
  • 1-(1,1-Dimethylethyl) (2S,4R)-4-[(3-chlorophenyl)methyl]-1,2-pyrrolidinedicarboxylate
  • (2S,4R)-1-[(tert-butoxy)carbonyl]-4-[(3-chlorophenyl)methyl]pyrrolidine-2-carboxylic acid
  • N-(t-Butoxycarbonyl)-trans-4-(3-chlorobenzyl)-L-proline
  • (Tert-Butoxy)Carbonyl (R)-γ-(3-chloro-benzyl)-L-Pro
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