CAS 80937-23-1

(2E)-4-(3,4-Dimethoxyphenyl)-4-oxo-2-butenoic acid

Description:

(2E)-4-(3,4-Dimethoxyphenyl)-4-oxo-2-butenoic acid, with the CAS number 80937-23-1, is an organic compound characterized by its unique structural features. It contains a butenoic acid backbone, which is a conjugated system that contributes to its reactivity and potential biological activity. The presence of the 3,4-dimethoxyphenyl group enhances its lipophilicity and may influence its interaction with biological targets. This compound typically exhibits properties such as being a solid at room temperature, with potential solubility in organic solvents due to its aromatic and aliphatic components. Its functional groups suggest it may participate in various chemical reactions, including esterification and condensation. Additionally, the compound may exhibit interesting pharmacological properties, making it a subject of interest in medicinal chemistry. However, specific details regarding its stability, reactivity, and biological activity would require further investigation through experimental studies. Overall, this compound represents a class of molecules that could have applications in pharmaceuticals or agrochemicals.

Formula: C₁₂H₁₂O₅

InChI: InChI=1S/C12H12O5/c1-16-10-5-3-8(7-11(10)17-2)9(13)4-6-12(14)15/h3-7H,1-2H3,(H,14,15)/b6-4+

InChI key: InChIKey=QUWWWXPLUJFEHM-GQCTYLIASA-N

SMILES: C(/C=C/C(O)=O)(=O)C1=CC(OC)=C(OC)C=C1

Synonyms:

• (2E)-4-(3,4-Dimethoxyphenyl)-4-oxo-2-butenoic acid
• 2-Butenoic acid, 4-(3,4-dimethoxyphenyl)-4-oxo-, (E)-
• 2-Butenoic acid, 4-(3,4-dimethoxyphenyl)-4-oxo-, (2E)-
• trans-β-(m,p-Dimethoxybenzoyl)acrylic acid