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. 2021 Jan 13;26(2):390. doi: 10.3390/molecules26020390

Table 1.

Parameters of the modified Apelblat model (AM) equation, van’t Hoff model (VHM) equation and Buchowski–Ksiazaczak λh model (BKM) equation for ABN401 in organic solvents and their respective relative mean standard deviation (RMSD) values.

Solvents AM VHM BKM
A B C RMSD*10−4 a b RMSD*10−4 λ *10−2 h*10−3 RMSD*10−4
Water −374.54 14,006.70 55.25 0.001 −2.72 −2997.05 0.001 0.003 81,500 0.001
Methanol 490.45 −26,827.80 −72.07 0.032 5.46 −4646.29 0.013 0.294 1552.96 0.014
Ethanol 787.98 −41,435.30 −115.39 0.189 11.44 −5922.71 0.276 5.973 99.60 0.291
1-Propanol 273.94 −14,746.60 −40.67 0.132 0.25 −2229.99 0.163 0.298 581.15 0.187
2-Propanol 205.50 −13,595.70 −29.52 0.086 6.88 −4512.17 0.102 1.643 268.80 0.108
1-Butanol −65.44 1399.93 9.42 0.224 −2.07 −1497.91 0.108 0.061 954.68 0.111
2-Butanol 841.86 −43,078.50 −123.77 0.198 8.97 −4988.55 0.250 4.456 110.99 0.270
Acetonitrile 120.15 −7033.34 −18.25 0.138 −2.66 −1417.25 0.140 0.040 1349 0.157
Acetone −318.55 12,641.10 47.25 0.230 −0.58 −1900.52 0.241 0.225 570.21 0.233
Ethyl acetate −31.99 264.30 4.17 0.029 −3.93 −1018.83 0.017 0.019 1936.12 0.026
THP 456.50 −23,707.90 −67.25 0.620 3.92 −3010.37 0.777 2.587 106.47 0.859
Overall 0.171 0.190 0.205

* Relative uncertainties, u(A) = 3.04, u(B) = 4.95, u(C) = 3.07, u(a) = 0.13, u(b) = 0.19, u(λ) = 0.02, u(h) = 3.19.