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Development, Synthesis, and in silico Investigations of Novel Acyclic Allyl Fluoride Derivatives
Synthesis ( IF 2.2 ) Pub Date : 2022-11-23 , DOI: 10.1055/a-1961-8013 Nishita Chauhan 1 , Harjinder Singh 2 , Kamal Nain Singh 3 , Jeffrey McKenna 4 , Vaneet Saini 1
中文翻译：
新型无环烯丙基氟衍生物的开发、合成和计算机研究
更新日期：2022-11-24
Synthesis ( IF 2.2 ) Pub Date : 2022-11-23 , DOI: 10.1055/a-1961-8013 Nishita Chauhan 1 , Harjinder Singh 2 , Kamal Nain Singh 3 , Jeffrey McKenna 4 , Vaneet Saini 1
Affiliation
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A one step electrophilic fluorination of alkenes is reported, which furnishes the products in a highly regioselective manner via allylic rearrangement. The reaction proceeds efficiently under mild conditions with the use of trisubstituted alkenes as olefin partner and Selectfluor as an electrophilic fluorinating agent without the need of any transition metal catalyst or pre-functionalized substrates. Virtual screening of the newly synthesized compounds shows their potential application as herbicides by inhibiting protoporphyrinogen oxidase (PPO) enzyme.
中文翻译：
新型无环烯丙基氟衍生物的开发、合成和计算机研究
报道了烯烃的一步亲电氟化，通过烯丙基重排以高度区域选择性的方式提供产品。该反应在温和条件下有效进行，使用三取代烯烃作为烯烃伙伴，使用 Selectfluor 作为亲电氟化剂，无需任何过渡金属催化剂或预官能化底物。新合成化合物的虚拟筛选显示了它们通过抑制原卟啉原氧化酶 (PPO) 作为除草剂的潜在应用。
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