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CAS 72180-27-9

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1-(Phenylmethyl) (2S)-4,4-difluoro-1,2-pyrrolidinedicarboxylate

Description:
1-(Phenylmethyl)(2S)-4,4-difluoro-1,2-pyrrolidinedicarboxylate, with the CAS number 72180-27-9, is a chemical compound characterized by its pyrrolidine structure, which features two carboxylate groups and a phenylmethyl substituent. The presence of difluoro groups indicates that two fluorine atoms are attached to the carbon backbone, which can significantly influence the compound's reactivity and physical properties, such as polarity and boiling point. This compound is likely to exhibit interesting pharmacological properties due to its structural features, making it a subject of interest in medicinal chemistry. The stereochemistry, denoted by the (2S) configuration, suggests specific spatial arrangements that can affect biological activity and interactions with biological targets. Additionally, the presence of both aromatic and aliphatic components in its structure may contribute to its solubility characteristics and potential applications in various chemical syntheses or as a pharmaceutical intermediate. Overall, this compound exemplifies the complexity and diversity found in organic chemistry, particularly in the design of molecules with specific functional properties.
Formula:C13H13F2NO4
InChI:InChI=1S/C13H13F2NO4/c14-13(15)6-10(11(17)18)16(8-13)12(19)20-7-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,17,18)/t10-/m0/s1
InChI key:InChIKey=ICXGOKDOIFGMDR-JTQLQIEISA-N
SMILES:C(OCC1=CC=CC=C1)(=O)N2[C@H](C(O)=O)CC(F)(F)C2
Synonyms:
  • 1-(Phenylmethyl) (2S)-4,4-difluoro-1,2-pyrrolidinedicarboxylate
  • (2S)-1-Benzyloxycarbonyl-4,4-difluoroproline
  • 1,2-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(phenylmethyl) ester, (2S)-
  • 1,2-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(phenylmethyl) ester, (S)-
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