Skip to main content
. 2020 May 6;11(22):5676–5689. doi: 10.1039/d0sc02020f

Table 2. Inhibition rate constants (kinh) and stoichiometries (n) of QMs and phenols during inhibited co-autoxidations of cumene (3.6 M) and STY-BODIPY (10 μM) or hexadecene (2.9 M) and PBD-BODIPY initiated by AIBN (6 mM) in chlorobenzene at 37 °C alongside calculated addition rate constants (kcalcadd, gas phase, 37 °C) and literature kinh values (klitinh, cumene or styrene, 60 °C).

Y Z k calc add (104 M–1 s–1) k lit inh a (104 M–1 s–1) n a k hexadecene inh (104 M–1 s–1) n k cumene inh (104 M–1 s–1) n
4e Me Me 80 1.6 0.9 ND ND
4a H Me 10 0.058 1.1 8.2 ± 0.2 2.0 ± 0.1 0.72 ± 0.03 2.2 ± 0.1
4a-H2O c NA ND 8.3 ± 0.6 2.0 b 0.84 ± 0.09 2.1 ± 0.1
4b H Ph 0.01 0.018 0.5 Retards 0.34 ± 0.03 1.9 ± 0.1
4f Ph Ph 0.0002 Does not inhibit ND ND
5a c ND 8.1 ± 0.2 2.2 ± 0.1 0.75 ± 0.06 2.4 ± 0.1
5b c 0.01 6.4 ± 0.1 2.4 ± 0.1 1.10 ± 0.03 2.4 ± 0.1

aData from ref. 17.

bStoichiometry set to n = 2.0 to determine kinh, [4a-H2O] = 5 μM.

cThe data primarily reflect HAT.