Deoxyfluorination with Sulfonyl Fluorides: Navigating Reaction Space with Machine Learning

Nielsen, Matthew K.; Ahneman, Derek T.; Riera, Orestes; Doyle, Abigail G.

Deoxyfluorination with Sulfonyl Fluorides: Navigating Reaction Space with Machine Learning

2018

Nielsen, Matthew K. | Ahneman, Derek T. | Riera, Orestes | Doyle, Abigail G.

Through fine-tuning of reagent and base structure, sulfonyl fluorides can efficiently fluorinate diverse classes of alcohols. We show that machine learning can map the intricate reaction landscape and enable accurate prediction of high-yielding conditions for untested substrates.

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