CAS 70080-55-6

4-Ethoxy-α-oxobenzeneacetic acid

Description:

4-Ethoxy-α-oxobenzeneacetic acid, identified by its CAS number 70080-55-6, is an organic compound characterized by its aromatic structure and functional groups. It features an ethoxy group (-OCH2CH3) attached to a benzene ring, along with a ketone (α-oxo) and a carboxylic acid (-COOH) functional group. This compound typically exhibits properties such as moderate solubility in organic solvents and varying solubility in water, influenced by the presence of the polar carboxylic acid group. Its molecular structure suggests potential reactivity, particularly in condensation and esterification reactions, making it of interest in organic synthesis and medicinal chemistry. The presence of the ethoxy group may enhance lipophilicity, potentially affecting its biological activity and interaction with other molecules. As with many organic compounds, safety data should be consulted for handling and usage, as it may pose risks such as irritation or toxicity. Overall, 4-Ethoxy-α-oxobenzeneacetic acid represents a versatile compound with applications in various chemical research fields.

Formula: C₁₀H₁₀O₄

InChI: InChI=1S/C10H10O4/c1-2-14-8-5-3-7(4-6-8)9(11)10(12)13/h3-6H,2H2,1H3,(H,12,13)

InChI key: InChIKey=ISHDMYCQBZTUSC-UHFFFAOYSA-N

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

Synonyms:

• (4-Ethoxyphenyl)glyoxylic acid
• (p-Ethoxyphenyl)glyoxylic acid
• Benzeneacetic acid, 4-ethoxy-α-oxo-
• α-Oxo-4-ethoxyphenylacetic acid
• 4-Ethoxy-α-oxobenzeneacetic acid