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CAS 849035-95-6

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Benzoic acid, 2-(4-piperidinylsulfonyl)-, methyl ester, hydrochloride (1:1)

Description:
Benzoic acid, 2-(4-piperidinylsulfonyl)-, methyl ester, hydrochloride (1:1), with the CAS number 849035-95-6, is a chemical compound characterized by its benzoic acid core modified with a piperidine sulfonamide group. This compound typically appears as a white to off-white solid and is soluble in polar solvents such as water and methanol, owing to the presence of the hydrochloride salt form. The piperidine ring contributes to its potential biological activity, making it of interest in medicinal chemistry, particularly for its possible applications in pharmaceuticals. The sulfonyl group enhances the compound's reactivity and solubility, which can influence its pharmacokinetic properties. As a hydrochloride salt, it is often more stable and easier to handle than its free base form. Safety data should be consulted for handling and usage, as with any chemical substance, to ensure proper precautions are taken. Overall, this compound represents a unique structure that may exhibit interesting chemical and biological properties.
Formula:C13H17NO4S·ClH
InChI:InChI=1S/C13H17NO4S.ClH/c1-18-13(15)11-4-2-3-5-12(11)19(16,17)10-6-8-14-9-7-10;/h2-5,10,14H,6-9H2,1H3;1H
InChI key:InChIKey=WUFLZEIPMRELMF-UHFFFAOYSA-N
SMILES:S(=O)(=O)(C1=C(C(OC)=O)C=CC=C1)C2CCNCC2.Cl
Synonyms:
  • Benzoic acid, 2-(4-piperidinylsulfonyl)-, methyl ester, hydrochloride
  • Benzoicacid, 2-(4-piperidinylsulfonyl)-, methyl ester, hydrochloride (9CI)
  • Benzoic acid, 2-(4-piperidinylsulfonyl)-, methyl ester, hydrochloride (1:1)
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