CAS 898758-53-7

Ethyl 2,6-dimethoxy-η-oxobenzeneoctanoate

Description:

Ethyl 2,6-dimethoxy-η-oxobenzeneoctanoate, identified by its CAS number 898758-53-7, is a chemical compound that belongs to the class of esters. This substance features a complex structure characterized by an ethyl ester group linked to a benzene ring that is further substituted with two methoxy groups at the 2 and 6 positions, as well as an octanoate chain. The presence of the methoxy groups contributes to its potential solubility in organic solvents and may influence its reactivity and interaction with biological systems. The octanoate chain adds hydrophobic characteristics, which can affect the compound's behavior in various environments, including its partitioning in biological membranes. Ethyl 2,6-dimethoxy-η-oxobenzeneoctanoate may exhibit interesting properties such as potential applications in pharmaceuticals, agrochemicals, or as a synthetic intermediate in organic chemistry. However, specific data regarding its physical properties, such as boiling point, melting point, and solubility, would require further investigation or experimental determination.

Formula: C₁₈H₂₆O₅

InChI: InChI=1S/C18H26O5/c1-4-23-17(20)13-8-6-5-7-10-14(19)18-15(21-2)11-9-12-16(18)22-3/h9,11-12H,4-8,10,13H2,1-3H3

InChI key: InChIKey=YSFIEJZHTQCFCB-UHFFFAOYSA-N

SMILES: C(CCCCCCC(OCC)=O)(=O)C1=C(OC)C=CC=C1OC

Synonyms:

• Benzeneoctanoic acid, 2,6-dimethoxy-η-oxo-, ethyl ester
• Ethyl 2,6-dimethoxy-η-oxobenzeneoctanoate