Hydroxyl-terminated carbon dots for efficient conversion of cyclohexane to adipic acid

Hydroxyl-terminated CDs can efficiently one-step covert cyclohexane to adipic acid under 130 °C, 20 atm with oxygen as oxidant. Adipic acid (HOOC(CH 2 ) 4 COOH, AA) is a crucial chemical in industrial manufactures and mainly produced by the oxidation of cyclohexane with air and nitric acid via a homogeneous two step path in industry. However, the conventional industrial method inevitably results in the generation of nitrous oxide (N 2 O, etc.), which is the main cause of the greenhouse effect and ozone depletion. Herein, we engineered five kinds of carbon dots (CDs) with different oxygen-containing functional groups on their surfaces, which were directly used as catalysts over the selective catalytic oxidation of cyclohexane. Among the five CDs, the hydroxyl-terminated CDs show the best catalytic activity with the conversion of cyclohexane ~ 29.43% and selectivity to AA ~ 95.89% under 130 °C, 20 atm with oxygen as oxidant. With the CDs directly as catalyst, the one-step efficient catalytic oxidation reaction for cyclohexane to AA was realized to replace the two-step routes. In addition, the density functional theory (DFT) computational results were performed to further prove that the more quantity of hydroxyl on CDs and the higher O 2 pressure can boost the higher catalytic activity of CDs over oxidation of cyclohexane.