CAS 1111103-05-9

Methyl 3-(1,6-dihydro-6-oxo-3-pyridinyl)benzoate

Description:

Methyl 3-(1,6-dihydro-6-oxo-3-pyridinyl)benzoate, identified by its CAS number 1111103-05-9, is an organic compound characterized by its ester functional group, which is derived from benzoic acid and a pyridine derivative. This compound features a methyl ester group attached to a benzoate moiety, along with a pyridine ring that contains a keto group, contributing to its unique chemical properties. It is typically a solid or liquid at room temperature, depending on its specific formulation and purity. The presence of the pyridine ring suggests potential biological activity, as many pyridine derivatives are known for their pharmacological properties. Methyl 3-(1,6-dihydro-6-oxo-3-pyridinyl)benzoate may exhibit solubility in organic solvents, while its reactivity can be influenced by the functional groups present. Its synthesis and applications could be relevant in medicinal chemistry, particularly in the development of pharmaceuticals or agrochemicals. As with any chemical substance, proper handling and safety measures should be observed due to potential toxicity or reactivity.

Formula: C₁₃H₁₁NO₃

InChI: InChI=1S/C13H11NO3/c1-17-13(16)10-4-2-3-9(7-10)11-5-6-12(15)14-8-11/h2-8H,1H3,(H,14,15)

InChI key: InChIKey=ZFJRANMVHKZKIV-UHFFFAOYSA-N

SMILES: C(OC)(=O)C=1C=C(C=CC1)C=2C=CC(=O)NC2

Synonyms:

• Methyl 3-(1,6-dihydro-6-oxo-3-pyridinyl)benzoate
• Benzoic acid, 3-(1,6-dihydro-6-oxo-3-pyridinyl)-, methyl ester