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CAS 62088-13-5

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3-(3-Cyano-Phenyl)-3-Oxo-Propionic Acid Ethyl Ester

Description:
3-(3-Cyano-Phenyl)-3-Oxo-Propionic Acid Ethyl Ester, with the CAS number 62088-13-5, is an organic compound characterized by its ester functional group and the presence of a cyano group attached to a phenyl ring. This compound typically exhibits a molecular structure that includes a propionic acid backbone, which contributes to its reactivity and potential applications in organic synthesis. The cyano group (-CN) enhances the compound's polarity and can influence its solubility in various solvents, making it useful in chemical reactions, particularly in the synthesis of more complex molecules. The ethyl ester moiety provides a degree of hydrophobicity, which can affect its interaction with biological systems and its overall stability. Additionally, the compound may exhibit interesting optical and electronic properties due to the conjugation between the cyano-substituted phenyl group and the carbonyl functionalities. Overall, this compound is of interest in fields such as medicinal chemistry and materials science, where its unique structural features can be leveraged for the development of new materials or pharmaceuticals.
Formula:C12H11NO3
InChI:InChI=1/C12H11NO3/c1-2-16-12(15)7-11(14)10-5-3-4-9(6-10)8-13/h3-6H,2,7H2,1H3
SMILES:CCOC(=O)CC(=O)c1cccc(c1)C#N
Synonyms:
  • Benzenepropanoic Acid, 3-Cyano-Β-Oxo-, Ethyl Ester
  • Ethyl 3-(3-Cyanophenyl)-3-Oxopropanoate
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