CAS 1220017-49-1

Benzoic acid, 2-[[2-(4-piperidinyl)ethoxy]methyl]-, methyl ester, hydrochloride (1:1)

Description:

Benzoic acid, 2-[[2-(4-piperidinyl)ethoxy]methyl]-, methyl ester, hydrochloride (1:1), identified by CAS number 1220017-49-1, is a chemical compound characterized by its benzoic acid core modified with a piperidine-derived side chain. This compound typically appears as a white to off-white crystalline solid and is soluble in polar solvents such as water and alcohols due to the presence of the hydrochloride salt form. The piperidine moiety contributes to its potential biological activity, making it of interest in pharmaceutical research. The ester functional group indicates that it may undergo hydrolysis under certain conditions, releasing benzoic acid and the corresponding alcohol. Its hydrochloride form enhances stability and solubility, which is advantageous for formulation in various applications. As with many compounds containing piperidine, it may exhibit psychoactive properties, warranting careful handling and study. Overall, this compound's unique structure and properties make it a subject of interest in medicinal chemistry and related fields.

Formula: C₁₆H₂₃NO₃·ClH

InChI: InChI=1S/C16H23NO3.ClH/c1-19-16(18)15-5-3-2-4-14(15)12-20-11-8-13-6-9-17-10-7-13;/h2-5,13,17H,6-12H2,1H3;1H

InChI key: InChIKey=CXSVXHUUDJUMCI-UHFFFAOYSA-N

SMILES: C(OCCC1CCNCC1)C2=C(C(OC)=O)C=CC=C2.Cl

Synonyms:

• Benzoic acid, 2-[[2-(4-piperidinyl)ethoxy]methyl]-, methyl ester, hydrochloride (1:1)