Metal-free intermolecular formal cycloadditions enable an orthogonal access to nitrogen heterocycles.

Xie, Lan-Gui; Niyomchon, Supaporn; Mota, Antonio J; González, Leticia; Maulide, Nuno · Nat Commun · 2016

basic_science · Level V

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Abstract

Nitrogen-containing heteroaromatic cores are ubiquitous building blocks in organic chemistry. Herein, we present a family of metal-free intermolecular formal cycloaddition reactions that enable highly selective and orthogonal access to isoquinolines and pyrimidines at will. Applications of the products are complemented by a density functional theory mechanistic analysis that pinpoints the crucial factors responsible for the selectivity observed, including stoichiometry and the nature of the heteroalkyne.

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