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Catalytic Lactonization of Unactivated Aryl C-H Bonds with CO2: Experimental and Computational Investigation.

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The first catalytic lactonization of unactivated aryl C-H bonds with CO2 to afford important phthalides is reported. Notably, this method features high selectivity, excellent functional group tolerance, smooth scalability, and… Click to show full abstract

The first catalytic lactonization of unactivated aryl C-H bonds with CO2 to afford important phthalides is reported. Notably, this method features high selectivity, excellent functional group tolerance, smooth scalability, and facile product diversification. DFT calculations reveal that a novel insertion of two CO2 into the O-Pd bond of a palladacycle might be the key step, providing great potential and a different perspective for carbonylation with CO2.

Keywords: bonds co2; aryl bonds; lactonization unactivated; catalytic lactonization; unactivated aryl

Journal Title: Organic letters
Year Published: 2018

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