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. 2022 Mar 1;7(10):8591–8600. doi: 10.1021/acsomega.1c06468

Table 2. Experimental and Fitted Solubility Data of MET·HCl in Water + Acetonitrile (P = 0.1 MPa)a,b.

graphic file with name ao1c06468_m025.jpg
103x1exp 103x1apelblat 103x1CNIBS 103x1AJA 103x1λh
283.15 K
0.30 3.730 3.656 3.825 3.394 3.648
0.40 7.404 7.356 6.648 7.137 7.154
0.50 9.214 9.898 10.84 11.94 11.07
0.60 17.61 17.43 16.26 17.09 17.16
0.70 22.86 22.85 22.14 21.99 23.05
0.80 26.14 25.62 27.20 26.20 25.76
0.90 30.29 29.75 30.16 29.15 30.92
1.00 30.45 30.27 30.36 29.89 31.26
288.15 K
0.30 3.861 4.016 3.872 3.823 4.019
0.40 8.137 8.103 8.035 7.995 8.019
0.50 13.15 11.94 13.38 13.36 12.54
0.60 18.93 19.27 19.06 19.14 19.16
0.70 25.49 25.49 24.40 24.70 25.58
0.80 27.56 28.58 28.96 29.56 28.67
0.90 33.17 34.04 32.37 33.07 34.72
1.00 33.85 34.32 34.01 34.15 34.62
293.15 K
0.30 4.530 4.407 4.504 4.292 4.418
0.40 8.710 8.945 8.875 8.922 8.963
0.50 14.95 14.11 14.73 14.88 14.15
0.60 21.39 21.30 21.35 21.32 21.33
0.70 28.21 28.31 27.85 27.58 28.30
0.80 32.03 31.78 33.39 33.13 31.81
0.90 38.59 38.50 37.31 37.24 38.45
1.00 38.75 38.66 39.09 38.69 38.63
298.15 K
0.30 4.688 4.831 4.687 4.802 4.847
0.40 9.941 9.894 9.920 9.919 9.989
0.50 16.43 16.34 16.55 16.50 15.91
0.60 23.62 23.54 23.65 23.64 23.67
0.70 31.50 31.33 30.64 30.63 31.24
0.80 35.61 35.21 37.09 36.89 35.19
0.90 43.16 43.10 42.12 41.63 42.46
1.00 43.60 43.25 43.83 43.49 42.97
303.15 K
0.30 5.517 5.290 5.510 5.355 5.308
0.40 11.11 10.96 11.11 10.99 11.10
0.50 18.07 18.57 18.18 18.22 17.84
0.60 25.98 26.02 25.88 26.09 26.21
0.70 34.43 34.53 33.60 33.84 34.40
0.80 39.06 38.89 40.81 40.85 38.84
0.90 47.83 47.76 46.48 46.25 46.77
1.00 48.33 48.09 48.65 48.53 47.66
308.15 K
0.30 5.834 5.787 5.833 5.956 5.804
0.40 12.28 12.17 12.24 12.13 12.31
0.50 19.97 20.73 20.23 20.05 19.95
0.60 28.88 28.76 28.66 28.67 28.95
0.70 37.81 37.94 36.93 37.20 37.79
0.80 42.75 42.83 44.66 44.97 42.76
0.90 52.37 52.43 50.93 51.04 51.39
1.00 53.25 53.17 53.59 53.77 52.71
313.15 K
0.30 6.261 6.324 6.257 6.604 6.336
0.40 13.43 13.53 13.42 13.36 13.62
0.50 22.10 22.77 22.30 21.97 22.24
0.60 31.74 31.78 31.60 31.38 31.90
0.70 41.75 41.54 40.73 40.70 41.44
0.80 47.20 47.03 49.31 49.25 46.97
0.90 57.67 57.05 56.09 56.01 56.35
1.00 57.72 58.46 58.09 59.18 58.15
318.15 K
0.30 6.739 6.90 6.742 7.303 6.908
0.40 15.03 15.06 14.96 14.66 15.05
0.50 24.68 24.62 24.99 24.01 24.73
0.60 35.20 35.11 35.00 34.20 35.09
0.70 45.31 45.33 44.31 44.33 45.34
0.80 51.00 51.50 52.94 53.66 51.49
0.90 61.76 61.56 60.36 61.11 61.65
1.00 63.98 63.94 64.31 64.73 63.98
323.15 K
0.30 7.65 7.531 7.669 8.056 7.522
0.40 16.77 16.78 16.60 16.04 16.58
0.50 27.20 26.23 27.60 26.14 27.44
0.60 38.67 38.78 38.59 37.14 38.51
0.70 49.28 49.33 48.55 48.08 49.53
0.80 56.44 56.24 57.37 58.19 56.34
0.90 65.34 65.90 64.90 66.32 67.32
1.00 69.87 69.59 69.95 70.39 70.25
a

x1 is the experimental solubility; the x1apelblat, x1CNIBSx1λh, and x1AJA are the calculated mole solubilities according to the modified Apelblat model, CNIBS/R-K model, λh model, and Apelblat–Jouyban–Acree model, respectively. Inline graphic represents the initial mole fraction of water in the binary aqueous solvent.

b

The standard uncertainty is u(T) = 0.1 K; the relative standard uncertainties ur are ur(P) = 0.01, ur(x1) = 0.05, and ur(Inline graphic) = 0.001.