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CAS 898766-73-9

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2,2-dimethyl-4-(4-methylsulfanylphenyl)-4-oxo-butanoic acid

Description:
2,2-Dimethyl-4-(4-methylsulfanylphenyl)-4-oxo-butanoic acid is an organic compound characterized by its complex structure, which includes a butanoic acid backbone with various substituents. The presence of two methyl groups at the second carbon position contributes to its branched nature, while the ketone functional group at the fourth carbon indicates its potential reactivity in various chemical reactions. The para-methylsulfanylphenyl group enhances its aromatic character and may influence its solubility and interaction with biological systems. This compound is likely to exhibit moderate polarity due to the combination of hydrophobic (aromatic and alkyl groups) and hydrophilic (carboxylic acid) functionalities. Its unique structure may confer specific biological activities, making it of interest in pharmaceutical research. Additionally, the presence of sulfur in the methylthio group can affect the compound's electronic properties and reactivity. Overall, 2,2-dimethyl-4-(4-methylsulfanylphenyl)-4-oxo-butanoic acid represents a versatile molecule with potential applications in various fields, including medicinal chemistry and materials science.
Formula:C13H16O3S
InChI:InChI=1/C13H16O3S/c1-13(2,12(15)16)8-11(14)9-4-6-10(17-3)7-5-9/h4-7H,8H2,1-3H3,(H,15,16)
SMILES:CC(C)(CC(=O)c1ccc(cc1)SC)C(=O)O
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