Kopf, Sara; Liu, Jiali; Franke, Robert; Jiao, Haijun; Neumann, Helfried; Beller, Matthias published the artcile< Base-Mediated Remote Deuteration of N-Heteroarenes - Broad Scope and Mechanism>, Computed Properties of 84163-77-9, the main research area is heteroarene deuterated dimethyl sulfoxide regioselective deuteration; deuterated heteroarene preparation.
Using KOtBu as base and DMSO-d6 as deuterium source, a general and applicable method was presented for the selective deuteration of a set of nitrogen-containing heterocycles (pyridines, azines and bioactive mols.). Exptl. and DFT mechanistic studies indicated that this reaction proceeded via deprotonation of the substrates by the dimsyl anion. The relative thermodn. stability of the heterocycle anions determines the distribution and degree of deuteration.
European Journal of Organic Chemistry published new progress about Deuteration, regioselective. 84163-77-9 belongs to class benzisoxazole, and the molecular formula is C12H13FN2O, Computed Properties of 84163-77-9.
Referemce:
Benzisoxazole – Wikipedia,
Benzisoxazole – an overview | ScienceDirect Topics