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Photochemical Allylation of Alkanes Enabled by Nickel Catalysis
ACS Catalysis ( IF 12.9 ) Pub Date : 2022-08-03 , DOI: 10.1021/acscatal.2c02345
Youxiang Jin 1 , Elvis Wang Hei Ng 1, 2 , Tao Fan 1 , Hajime Hirao 2 , Liu-Zhu Gong 1
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We have developed an allylic alkylation of alkanes by dual photo-HAT/nickel catalysis. In this reaction, radical-type hydrogen-atom-transfer of the alkanes is enabled by decatungstate as a photocatalyst, whereas nickel serves to cleave the C–O bond in the substrates under mild reaction conditions. This co-catalyzed reaction provides a method for direct functionalization of alkanes. Density functional theory calculations show that reductive elimination is the rate-determining step of this reaction.

中文翻译:

镍催化实现烷烃的光化学烯丙基化

我们通过双光-HAT/镍催化开发了烷烃的烯丙基烷基化。在该反应中,烷烃的自由基型氢原子转移是通过十钨酸盐作为光催化剂实现的,而镍则用于在温和的反应条件下裂解基材中的 C-O 键。这种共催化反应提供了一种烷烃直接官能化的方法。密度泛函理论计算表明,还原消除是该反应的速率决定步骤。
更新日期:2022-08-03
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