CAS 1219977-15-7

Benzoic acid, 4-(3-piperidinylmethoxy)-, phenylmethyl ester, hydrochloride (1:1)

Description:

Benzoic acid, 4-(3-piperidinylmethoxy)-, phenylmethyl ester, hydrochloride (1:1) is a chemical compound characterized by its complex structure, which includes a benzoic acid moiety, a piperidine ring, and a phenylmethyl ester group. This compound typically appears as a white to off-white crystalline solid and is soluble in polar solvents such as water and alcohols, 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 effects on the central nervous system. The presence of the ester functional group may influence its reactivity and stability, while the hydrochloride form enhances its solubility and bioavailability. As with many organic compounds, it is essential to handle this substance with care, following appropriate safety protocols due to potential toxicity and reactivity. Its specific applications and effects would depend on further research and characterization in the context of pharmacological studies.

Formula: C₂₀H₂₃NO₃·ClH

InChI: InChI=1S/C20H23NO3.ClH/c22-20(24-14-16-5-2-1-3-6-16)18-8-10-19(11-9-18)23-15-17-7-4-12-21-13-17;/h1-3,5-6,8-11,17,21H,4,7,12-15H2;1H

InChI key: InChIKey=PKCYHOZQCPZEHA-UHFFFAOYSA-N

SMILES: C(OCC1=CC=CC=C1)(=O)C2=CC=C(OCC3CCCNC3)C=C2.Cl

Synonyms:

• Benzoic acid, 4-(3-piperidinylmethoxy)-, phenylmethyl ester, hydrochloride (1:1)