Mechanisms of molecular-oxygen-mediated selective hydroxyalkylation and alkylation of quinoxalin-2(1 H )-ones with alkylboronic acid: a DFT investigation
Abstract
The mechanisms of the molecular-oxygen-mediated selective hydroxyalkylation and alkylation of quinoxalin-2(1 H )-ones with alkylboronic acids have been investigated using the M06-2X-D3/ma-def2-SVP method and basis set.
Fields of Study & Subjects
Metal-Catalyzed Oxygenation Mechanisms
Synthesis and Biological Evaluation
Oxidative Organic Chemistry Reactions
Publication details
- Journal / source
- Organic & Biomolecular Chemistry
- Volume
- 24
- Issue
- 12
- Pages
- 2532–2541
- Publication date
- 1 January 2026
- Language
- EN