CAS 133860-42-1

1-(3-Hydroxy-5-methyl-2-thienyl)ethanone

Description:

1-(3-Hydroxy-5-methyl-2-thienyl)ethanone, with the CAS number 133860-42-1, is an organic compound characterized by its thienyl structure, which incorporates a thiophene ring with hydroxyl and methyl substituents. This compound features a ketone functional group, contributing to its reactivity and potential applications in organic synthesis. The presence of the hydroxyl group indicates that it may exhibit hydrogen bonding capabilities, influencing its solubility and interaction with other molecules. The methyl group enhances the compound's hydrophobic characteristics, which can affect its biological activity and partitioning in various environments. Additionally, the thienyl moiety may impart unique electronic properties, making it of interest in materials science and medicinal chemistry. Overall, this compound's structural features suggest potential utility in various chemical applications, including as a building block in the synthesis of more complex molecules or as a candidate for biological activity studies.

Formula: C₇H₈O₂S

InChI: InChI=1S/C7H8O2S/c1-4-3-6(9)7(10-4)5(2)8/h3,9H,1-2H3

InChI key: InChIKey=IOOPSZCABYNBDZ-UHFFFAOYSA-N

SMILES: C(C)(=O)C=1SC(C)=CC1O

Synonyms:

• Ethanone, 1-(3-hydroxy-5-methyl-2-thienyl)-
• 1-(3-Hydroxy-5-methyl-2-thienyl)ethanone
• 1-(3-Hydroxy-5-methylthiophen-2-yl)ethan-1-one
• 1-(3-Hydroxy-5-methylthiophen-2-yl)ethanone