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CAS 518047-78-4

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benzyl (2S,4S)-2-cyano-4-fluoro-pyrrolidine-1-carboxylate

Description:
Benzyl (2S,4S)-2-cyano-4-fluoro-pyrrolidine-1-carboxylate is a chemical compound characterized by its pyrrolidine structure, which includes a cyano group and a fluoro substituent. The presence of the cyano group (-C≡N) indicates potential reactivity, particularly in nucleophilic reactions, while the fluoro group can influence the compound's electronic properties and lipophilicity. The benzyl ester moiety contributes to the compound's stability and solubility in organic solvents. This compound is often of interest in medicinal chemistry due to its potential biological activity, particularly in the development of pharmaceuticals. The specific stereochemistry denoted by (2S,4S) suggests that the compound has defined spatial arrangements that can significantly affect its interaction with biological targets. Overall, this compound's unique combination of functional groups and stereochemistry makes it a valuable subject for research in synthetic and medicinal chemistry.
Formula:C13H13FN2O2
InChI:InChI=1/C13H13FN2O2/c14-11-6-12(7-15)16(8-11)13(17)18-9-10-4-2-1-3-5-10/h1-5,11-12H,6,8-9H2/t11-,12-/m0/s1
SMILES:c1ccc(cc1)COC(=O)N1C[C@H](C[C@H]1C#N)F
Synonyms:
  • Benzyl (2S,4S)-2-cyano-4-fluoropyrrolidine-1-carboxylate
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