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CAS 384338-21-0

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3-Piperidinol, 4-methyl-1-(phenylmethyl)-, 4-methylbenzenesulfonate (1:1)

Description:
3-Piperidinol, 4-methyl-1-(phenylmethyl)-, 4-methylbenzenesulfonate (1:1) is a chemical compound characterized by its piperidine ring structure, which is a six-membered saturated nitrogen-containing heterocycle. This compound features a piperidinol moiety, indicating the presence of a hydroxyl group (-OH) on the piperidine ring, contributing to its potential as a base and nucleophile. The presence of a phenylmethyl group suggests that it has aromatic characteristics, which can influence its reactivity and solubility. The 4-methylbenzenesulfonate portion indicates that the compound is a sulfonate ester, which can enhance its solubility in polar solvents and may affect its biological activity. This compound may exhibit properties typical of both piperidine derivatives and sulfonate esters, making it of interest in medicinal chemistry and organic synthesis. Its specific applications and biological activities would depend on further studies, including its interaction with biological targets and its pharmacokinetic properties.
Formula:C13H19NO·C7H8O3S
InChI:InChI=1S/C13H19NO.C7H8O3S/c1-11-7-8-14(10-13(11)15)9-12-5-3-2-4-6-12;1-6-2-4-7(5-3-6)11(8,9)10/h2-6,11,13,15H,7-10H2,1H3;2-5H,1H3,(H,8,9,10)
InChI key:InChIKey=IXZHVWWLFJWBQN-UHFFFAOYSA-N
SMILES:C(N1CC(O)C(C)CC1)C2=CC=CC=C2.S(=O)(=O)(O)C1=CC=C(C)C=C1
Synonyms:
  • 3-Piperidinol, 4-methyl-1-(phenylmethyl)-, 4-methylbenzenesulfonate (1:1)
  • 3-Piperidinol, 4-methyl-1-(phenylmethyl)-, 4-methylbenzenesulfonate (salt)
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