钯
化学
催化作用
卤化物
芳基
密度泛函理论
卤代芳基
有机化学
药物化学
组合化学
计算化学
烷基
作者
Takayuki Wakaki,Takaya Togo,Daisuke Yoshidome,Yoichiro Kuninobu,Motomu Kanai
出处
期刊:ACS Catalysis
[American Chemical Society]
日期:2018-03-08
卷期号:8 (4): 3123-3128
被引量:78
标识
DOI:10.1021/acscatal.8b00440
摘要
We developed a palladium-catalyzed C–H transformation that enabled the synthesis of ketones from aldehydes and (hetero)aryl halides. The use of picolinamide ligands was key to achieving the transformation. Heteroaryl ketones, as well as diaryl ketones, were synthesized in good to excellent yields, even in gram-scale, using this reaction. Results of density functional theory (DFT) calculations support the C–H bond activation pathway.
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