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CAS 895245-30-4

:

1,1-Dimethylethyl (3S,4S)-3,4-bis(hydroxymethyl)-1-pyrrolidinecarboxylate

Description:
1,1-Dimethylethyl (3S,4S)-3,4-bis(hydroxymethyl)-1-pyrrolidinecarboxylate, with the CAS number 895245-30-4, is a chemical compound characterized by its pyrrolidine structure, which includes a five-membered ring containing nitrogen. This compound features two hydroxymethyl groups attached to the 3 and 4 positions of the pyrrolidine ring, contributing to its potential reactivity and solubility in polar solvents. The presence of the tert-butyl group (1,1-dimethylethyl) enhances its steric bulk, which can influence its biological activity and interactions with other molecules. The stereochemistry at the 3 and 4 positions is specified as (3S,4S), indicating the specific spatial arrangement of the substituents, which is crucial for its biological function and properties. This compound may be of interest in medicinal chemistry and drug design due to its structural features that could interact with biological targets. However, specific applications, toxicity, and detailed physical properties would require further investigation and characterization in the context of its intended use.
Formula:C11H21NO4
InChI:InChI=1S/C11H21NO4/c1-11(2,3)16-10(15)12-4-8(6-13)9(5-12)7-14/h8-9,13-14H,4-7H2,1-3H3/t8-,9-/m0/s1
InChI key:InChIKey=HEFYZXCUGNIOCW-IUCAKERBSA-N
SMILES:C(OC(C)(C)C)(=O)N1C[C@@H](CO)[C@H](CO)C1
Synonyms:
  • 1,1-Dimethylethyl (3S,4S)-3,4-bis(hydroxymethyl)-1-pyrrolidinecarboxylate
  • 1-Pyrrolidinecarboxylic acid, 3,4-bis(hydroxymethyl)-, 1,1-dimethylethyl ester, (3S,4S)-
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