CAS 86620-81-7

methyl 4-(piperazin-1-ylmethyl)benzoate

Description:

Methyl 4-(piperazin-1-ylmethyl)benzoate, identified by its CAS number 86620-81-7, is an organic compound characterized by its ester functional group and a piperazine moiety. This compound features a benzoate structure, where a methyl ester is attached to a benzene ring that has a piperazinyl side chain. The presence of the piperazine ring contributes to its potential biological activity, as piperazine derivatives are often explored for their pharmacological properties, including anxiolytic and antidepressant effects. The compound is typically a white to off-white solid and is soluble in organic solvents, which is common for esters. Its molecular structure suggests it may participate in hydrogen bonding due to the presence of nitrogen atoms in the piperazine ring, influencing its reactivity and interactions with biological targets. As with many organic compounds, safety data should be consulted for handling and usage, particularly regarding toxicity and environmental impact. Overall, methyl 4-(piperazin-1-ylmethyl)benzoate represents a class of compounds with potential applications in medicinal chemistry.

Formula: C₁₃H₁₈N₂O₂

InChI: InChI=1/C13H18N2O2/c1-17-13(16)12-4-2-11(3-5-12)10-15-8-6-14-7-9-15/h2-5,14H,6-10H2,1H3

SMILES: COC(=O)c1ccc(cc1)CN1CCNCC1

Synonyms:

• Benzoic acid, 4-(1-piperazinylmethyl)-, methyl ester

Methyl 4-piperazin-1-ylmethylbenzoate

Controlled Product

CAS: 86620-81-7

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Formula: C₁₃H₁₈N₂O₂

Purity: Min. 95%

Molecular weight: 234.29 g/mol

Ref: 3D-FM154204