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CAS 1009377-06-3

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1,1-Dimethylethyl (2S,5R)-5-(hydroxymethyl)-2-methyl-1-piperidinecarboxylate

Description:
1,1-Dimethylethyl (2S,5R)-5-(hydroxymethyl)-2-methyl-1-piperidinecarboxylate, with the CAS number 1009377-06-3, is a chemical compound characterized by its piperidine structure, which includes a carboxylate functional group and a hydroxymethyl substituent. This compound features a chiral center, indicated by the (2S,5R) configuration, which contributes to its stereochemical properties and potential biological activity. The presence of the tert-butyl group (1,1-dimethylethyl) enhances its lipophilicity, potentially influencing its solubility and permeability in biological systems. The hydroxymethyl group may also participate in hydrogen bonding, affecting the compound's reactivity and interactions with other molecules. Such characteristics suggest that this compound could be of interest in medicinal chemistry, particularly in the development of pharmaceuticals, where stereochemistry and functional group positioning are crucial for biological activity. Further studies would be necessary to explore its specific applications and efficacy in various chemical or biological contexts.
Formula:C12H23NO3
InChI:InChI=1S/C12H23NO3/c1-9-5-6-10(8-14)7-13(9)11(15)16-12(2,3)4/h9-10,14H,5-8H2,1-4H3/t9-,10+/m0/s1
InChI key:InChIKey=VOQQCJIHTNEJEK-VHSXEESVSA-N
SMILES:C(OC(C)(C)C)(=O)N1C[C@H](CO)CC[C@@H]1C
Synonyms:
  • 1,1-Dimethylethyl (2S,5R)-5-(hydroxymethyl)-2-methyl-1-piperidinecarboxylate
  • 1-Piperidinecarboxylic acid, 5-(hydroxymethyl)-2-methyl-, 1,1-dimethylethyl ester, (2S,5R)-
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