(Raw Data Set) Construction of DBU-based Poly (ionic liquid)s for the Conversion of CO2, Glycerol, and Propylene Oxide into Glycerol Carbonate

Abstract

The development of efficient heterogeneous catalysts for upgrading CO2, a greenhouse gas, and glycerol (Gly), an untapped biomass resource, into glycerol carbonate (GC) remains a challenge. Herein, 1,8-diazabicyclo[5.4.0] undec-7-ene (DBU)-based poly (ionic liquid)s (PILs) were constructed for the one-pot synthesis of GC from CO2, Gly, and propylene oxide. Among them, P-DVB-DBUVBI-1 exhibited the best catalytic performance, achieving a GC yield of 90 % under optimal reaction conditions (100 degrees C, 6 h). The PIL catalyst was easily recovered and reused, as demonstrated by stable activity over five cycles. Density functional theory calculations showed that owing the strong positive charge delocalization ability of DBU onium, DBU-based PILs exhibit high nucleophilicity, which is the key to their efficient catalytic performance in the one-pot reaction.