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CAS 1233860-23-5

:

1,1-Dimethylethyl (3S)-3-(4-fluoro-2-nitrophenoxy)-1-pyrrolidinecarboxylate

Description:
1,1-Dimethylethyl (3S)-3-(4-fluoro-2-nitrophenoxy)-1-pyrrolidinecarboxylate is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring, a carboxylate group, and a nitrophenoxy substituent. The presence of the 4-fluoro-2-nitrophenoxy group suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the electron-withdrawing effects of the nitro and fluoro groups that can influence biological activity. The dimethyl substituents on the carbon atom adjacent to the pyrrolidine ring contribute to steric hindrance, which may affect the compound's reactivity and interaction with biological targets. This compound's chirality, indicated by the (3S) configuration, suggests that it may exhibit specific stereochemical properties that could be relevant in its biological function. Overall, the unique combination of functional groups and structural features makes this compound of interest for further research in various chemical and biological applications.
Formula:C15H19FN2O5
InChI:InChI=1S/C15H19FN2O5/c1-15(2,3)23-14(19)17-7-6-11(9-17)22-13-5-4-10(16)8-12(13)18(20)21/h4-5,8,11H,6-7,9H2,1-3H3/t11-/m0/s1
InChI key:InChIKey=YMQJZHYWQSCLEL-NSHDSACASA-N
SMILES:O(C1=C(N(=O)=O)C=C(F)C=C1)[C@@H]2CN(C(OC(C)(C)C)=O)CC2
Synonyms:
  • 1,1-Dimethylethyl (3S)-3-(4-fluoro-2-nitrophenoxy)-1-pyrrolidinecarboxylate
  • 1-Pyrrolidinecarboxylic acid, 3-(4-fluoro-2-nitrophenoxy)-, 1,1-dimethylethyl ester, (3S)-
  • (S)-tert-Butyl 3-(4-fluoro-2-nitrophenoxy)pyrrolidine-1-carboxylate
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