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. 2022 May 30;13:3005. doi: 10.1038/s41467-022-30560-9

Table 1.

Quantitative structure–activity relationship (QSAR) of pollutants between the number of active hydrogen atoms and the corresponding percentages of coupling reaction (CR) and polymerization reaction (PR) pathways in DOTP.

PhOH BPA 2,6-M-PhOH 4-CP
Pollutant structure graphic file with name 41467_2022_30560_Taba_HTML.gif graphic file with name 41467_2022_30560_Tabb_HTML.gif graphic file with name 41467_2022_30560_Tabc_HTML.gif graphic file with name 41467_2022_30560_Tabd_HTML.gif
Number of active H 3 4 1 2
PR ratio 86% 77% 17% 31%
CR ratio 14% 23% 83% 69%