CAS 898751-92-3

Ethyl 2-[2-(1-piperidinylmethyl)benzoyl]benzoate

Description:

Ethyl 2-[2-(1-piperidinylmethyl)benzoyl]benzoate, identified by its CAS number 898751-92-3, is a chemical compound that belongs to the class of esters and is characterized by its complex structure, which includes a piperidine ring and two aromatic rings. This compound typically exhibits properties such as being a solid or liquid at room temperature, depending on its specific formulation and purity. It is likely to be soluble in organic solvents due to its hydrophobic aromatic components, while its ester functional group may impart some degree of polarity. Ethyl 2-[2-(1-piperidinylmethyl)benzoyl]benzoate may have applications in medicinal chemistry, particularly in the development of pharmaceuticals, owing to the presence of the piperidine moiety, which is often associated with biological activity. Additionally, its synthesis and characterization would involve standard organic chemistry techniques, including spectroscopic methods for structural elucidation. Safety data should be consulted for handling and storage, as with any chemical substance.

Formula: C₂₂H₂₅NO₃

InChI: InChI=1S/C22H25NO3/c1-2-26-22(25)20-13-7-6-12-19(20)21(24)18-11-5-4-10-17(18)16-23-14-8-3-9-15-23/h4-7,10-13H,2-3,8-9,14-16H2,1H3

InChI key: InChIKey=KONINNGYORTZQB-UHFFFAOYSA-N

SMILES: C(=O)(C1=C(C(OCC)=O)C=CC=C1)C2=C(CN3CCCCC3)C=CC=C2

Synonyms:

• Benzoic acid, 2-[2-(1-piperidinylmethyl)benzoyl]-, ethyl ester
• Ethyl 2-[2-(1-piperidinylmethyl)benzoyl]benzoate