CAS 898769-81-8

3-(2-Methoxyphenyl)-1-[2-(methylthio)phenyl]-1-propanone

Description:

3-(2-Methoxyphenyl)-1-[2-(methylthio)phenyl]-1-propanone, identified by its CAS number 898769-81-8, is an organic compound characterized by its complex molecular structure, which includes a propanone functional group and two aromatic rings. The presence of a methoxy group (-OCH3) on one of the phenyl rings enhances its solubility in organic solvents and may influence its reactivity and interaction with biological systems. The methylthio group (-S-CH3) on the other phenyl ring can impart unique electronic properties, potentially affecting the compound's stability and reactivity. This compound is likely to exhibit moderate to high lipophilicity due to its aromatic components, which may facilitate its absorption in biological systems. Additionally, the structural features suggest potential applications in medicinal chemistry, particularly in the development of pharmaceuticals or agrochemicals. However, specific biological activity, toxicity, and environmental impact would require further investigation through empirical studies.

Formula: C₁₇H₁₈O₂S

InChI: InChI=1/C17H18O2S/c1-19-16-9-5-3-7-13(16)11-12-15(18)14-8-4-6-10-17(14)20-2/h3-10H,11-12H2,1-2H3

InChI key: InChIKey=UJLWMFKXCDKXGA-UHFFFAOYSA-N

SMILES: C(CCC1=C(OC)C=CC=C1)(=O)C2=C(SC)C=CC=C2

Synonyms:

• 3-(2-Methoxyphenyl)-1-[2-(methylsulfanyl)phenyl]-1-propanone
• 3-(2-Methoxyphenyl)-1-[2-(methylthio)phenyl]-1-propanone
• 1-Propanone, 3-(2-methoxyphenyl)-1-[2-(methylthio)phenyl]-

3-(2-methoxyphenyl)-2′-thiomethylpropiophenone

CAS: 898769-81-8

Formula: C₁₇H₁₈O₂S

Purity: 97.0%

Molecular weight: 286.39

Ref: 10-F205789