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CAS 83623-78-3

:

1-(1,1-Dimethylethyl) (2S,4S)-4-(phenylmethyl)-1,2-pyrrolidinedicarboxylate

Description:
1-(1,1-Dimethylethyl) (2S,4S)-4-(phenylmethyl)-1,2-pyrrolidinedicarboxylate, with the CAS number 83623-78-3, is a chemical compound characterized by its pyrrolidine structure, which features two carboxylate groups and a phenylmethyl substituent. This compound is typically a white to off-white solid at room temperature and is soluble in organic solvents, reflecting its non-polar characteristics due to the presence of the bulky tert-butyl group and the aromatic phenyl group. The stereochemistry indicated by the (2S,4S) configuration suggests specific spatial arrangements of the substituents, which can influence its reactivity and interactions in biological systems. This compound may exhibit interesting pharmacological properties, making it of interest in medicinal chemistry. Its synthesis and applications could be relevant in the development of pharmaceuticals or agrochemicals, although specific applications would depend on further research into its biological activity and efficacy. Safety data should be consulted for handling and usage, as with any chemical substance.
Formula:C17H23NO4
InChI:InChI=1S/C17H23NO4/c1-17(2,3)22-16(21)18-11-13(10-14(18)15(19)20)9-12-7-5-4-6-8-12/h4-8,13-14H,9-11H2,1-3H3,(H,19,20)/t13-,14-/m0/s1
InChI key:InChIKey=JPNHKKRLLDYCIZ-KBPBESRZSA-N
SMILES:C(OC(C)(C)C)(=O)N1[C@H](C(O)=O)C[C@H](CC2=CC=CC=C2)C1
Synonyms:
  • (4S)-4-Benzyl-1-(tert-butoxycarbonyl)-L-proline
  • 1,2-Pyrrolidinedicarboxylic acid, 4-(phenylmethyl)-, 1-(1,1-dimethylethyl) ester, (2S,4S)-
  • 1,2-Pyrrolidinedicarboxylic acid, 4-(phenylmethyl)-, 1-(1,1-dimethylethyl) ester, (2S-cis)-
  • 1-(1,1-Dimethylethyl) (2S,4S)-4-(phenylmethyl)-1,2-pyrrolidinedicarboxylate
  • 4(S)-Benzyl-1-(tert-butoxycarbonyl)-2(S)-pyrrolidinecarboxylic acid
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