Table 5.
Overview of experimental (superscript exp) and estimated (superscript est) water solubility data, sorted by the estimated values. Δest,exp is the difference between estimated and observed values on a log scale. The model based on all suitable data was used for the estimation.
| Cation[a] | Anion[b] | Δest,exp | Temperature [K] | ||
|---|---|---|---|---|---|
| IM16 | (C2F5)3PF3 | −5.93 | −5.98 | −0.05 | 293.15 |
| Pyr14 | (C2F5)3PF3 | −5.43 | −5.39 | 0.04 | 293.15 |
| Py8-4Me | (C2F5SO2)2N | −5.4 [21] | −5.11 | 0.29 | 298.15 |
| IM16 | (CF3SO2)3C | −5.04 | −4.99 | 0.05 | 293.15 |
| IM18 | (C2F5SO2)2N | −4.7 [23] | −4.99 | −0.29 | 298 |
| Py8-4Me | AsF6 | −4.91 [21] | −4.91 | 0 | 298.15 |
| Py8-4Me | (CF3SO2)2N | −5.09 [21] | −4.66 | 0.43 | 298.15 |
| Pyr18 | (CF3SO2)2N | −4.71 [22] | −4.56 | 0.15 | 298 |
| IM18 | (CF3SO2)2N | −4.5 [25] | −4.54 | −0.04 | 288.15 |
| IM18 | (CF3SO2)2N | −4.59 | −4.54 | 0.05 | 293.15 |
| IM18 | (CF3SO2)2N | −4.1 [27] | −4.54 | −0.44 | 293.15 |
| IM18 | (CF3SO2)2N | −4.49 [25] | −4.54 | −0.05 | 293.15 |
| IM18 | (CF3SO2)2N | −4.14 [24] | −4.54 | −0.4 | 296.5 |
| IM18 | (CF3SO2)2N | −4.1 [26] | −4.54 | −0.44 | 298 |
| IM18 | (CF3SO2)2N | −4.6 [23] | −4.54 | 0.06 | 298 |
| IM18 | (CF3SO2)2N | −4.47 [25] | −4.54 | −0.07 | 298.15 |
| Py6-4NMe2 | (CF3SO2)2N | −4.53 | −4.5 | 0.03 | 293.15 |
| Py6-4NMe2 | (CF3SO2)2N | −4.53 [24] | −4.5 | 0.03 | 296.5 |
| IM14 | (CF3SO2)3C | −4.44 [24] | −4.49 | −0.05 | 296.5 |
| Py8-4Me | (C4F9)SO3 | −4.63 [21] | −4.35 | 0.28 | 298.15 |
| IM17 | (CF3SO2)2N | −4.31 [25] | −4.29 | 0.02 | 288.15 |
| IM17 | (CF3SO2)2N | −4.3 [25] | −4.29 | 0.01 | 293.15 |
| IM17 | (CF3SO2)2N | −4.29 [25] | −4.29 | 0 | 298.15 |
| IM18 | (C4F9)SO3 | −4.23 [26] | −4.24 | −0.01 | 298 |
| IM16-2Me | (CF3SO2)2N | −4.15 [24] | −4.12 | 0.03 | 296.5 |
| IM16 | (CF3SO2)2N | −4.05 [25] | −4 | 0.05 | 288.15 |
| IM16 | (CF3SO2)2N | −4.18 | −4 | 0.18 | 293.15 |
| IM16 | (CF3SO2)2N | −3.86 [27] | −4 | −0.14 | 293.15 |
| IM16 | (CF3SO2)2N | −4.05 [25] | −4 | 0.05 | 293.15 |
| IM16 | (CF3SO2)2N | −4.03 [24] | −4 | 0.03 | 296.5 |
| IM16 | (CF3SO2)2N | −4.02 [25] | −4 | 0.02 | 298.15 |
| Pyr16 | (CF3SO2)2N | −4.12 | −3.94 | 0.18 | 293.15 |
| IM18 | PF6 | −3.95 [28] | −3.91 | 0.04 | 288.15 |
| IM18 | PF6 | −3.92 [28] | −3.91 | 0.01 | 293.15 |
| IM18 | PF6 | −3.93 | −3.91 | 0.02 | 293.15 |
| IM18 | PF6 | −3.46 [30] | −3.91 | −0.45 | 295 |
| IM18 | PF6 | −3.9 [28] | −3.91 | −0.01 | 298.15 |
| IM15 | (CF3SO2)2N | −3.74 [25] | −3.72 | 0.02 | 288.15 |
| IM15 | (CF3SO2)2N | −3.73 [25] | −3.72 | 0.01 | 293.15 |
| IM15 | (CF3SO2)2N | −3.71 [25] | −3.72 | −0.01 | 298.15 |
| Py8-4Me | PhBF3 | −3.6 [21] | −3.6 | 0 | 298.15 |
| Py4-3Me | (CF3SO2)2N | −3.7 [24] | −3.55 | 0.15 | 296.5 |
| Py4-4Me | (CF3SO2)2N | −3.69 [26] | −3.55 | 0.14 | 298 |
| Pip14 | (CF3SO2)2N | −3.78 [22] | −3.51 | 0.27 | 298 |
| IM14 | (CF3SO2)2N | −3.54 [25] | −3.5 | 0.04 | 288.15 |
| IM14 | (CF3SO2)2N | −3.5 | −3.5 | 0 | 293.15 |
| IM14 | (CF3SO2)2N | −3.53 [25] | −3.5 | 0.03 | 293.15 |
| IM14 | (CF3SO2)2N | −3.46 [27] | −3.5 | −0.04 | 293.15 |
| IM14 | (CF3SO2)2N | −3.49 [29] | −3.5 | −0.01 | 294.15 |
| IM14 | (CF3SO2)2N | −3.5 [24] | −3.5 | 0 | 296.5 |
| IM14 | (CF3SO2)2N | −3.51 [26] | −3.5 | 0.01 | 298 |
| IM14 | (CF3SO2)2N | −3.51 [25] | −3.5 | 0.01 | 298.15 |
| Pyr14 | (CF3SO2)2N | −3.57 | −3.41 | 0.16 | 293.15 |
| Pyr14 | (CF3SO2)2N | −3.59 [22] | −3.41 | 0.18 | 298 |
| IM16 | PF6 | −3.45 [28] | −3.37 | 0.08 | 288.15 |
| IM16 | PF6 | −3.35 | −3.37 | −0.02 | 293.15 |
| IM16 | PF6 | −3.41 [28] | −3.37 | 0.04 | 293.15 |
| IM16 | PF6 | −3.36 [28] | −3.37 | −0.01 | 298.15 |
| IM13 | (CF3SO2)2N | −3.29 [25] | −3.28 | 0.01 | 288.15 |
| IM13 | (CF3SO2)2N | −3.28 [25] | −3.28 | 0 | 293.15 |
| IM13 | (CF3SO2)2N | −3.27 [25] | −3.28 | −0.01 | 298.15 |
| Py4-4Me | (C4F9)SO3 | −3.03 [26] | −3.25 | −0.22 | 298 |
| IM14 | (C4F9)SO3 | −3.15 [26] | −3.2 | −0.05 | 298 |
| IM12 | (CF3SO2)2N | −3.12 [25] | −3.1 | 0.02 | 288.15 |
| IM12 | (CF3SO2)2N | −3.08 [27] | −3.1 | −0.02 | 293.15 |
| IM12 | (CF3SO2)2N | −3.1 [25] | −3.1 | 0 | 293.15 |
| IM12 | (CF3SO2)2N | −3.1 [24] | −3.1 | 0 | 296.5 |
| IM12 | (CF3SO2)2N | −3.08 [25] | −3.1 | −0.02 | 298.15 |
| Py8-4Me | CF3SO3 | −3.09 [21] | −3.09 | 0 | 298.15 |
| Mor11O2 | (CF3SO2)2N | −3.19 | −3.06 | 0.13 | 293.15 |
| Py8-4Me | BF4 | −2.98 [21] | −3.01 | −0.03 | 298.15 |
| IM18 | BF4 | −2.93 [30] | −2.9 | 0.03 | 295 |
| IM14 | PF6 | −3 [28] | −2.87 | 0.13 | 288.15 |
| IM14 | PF6 | −2.8 [27] | −2.87 | −0.07 | 293.15 |
| IM14 | PF6 | −2.9 | −2.87 | 0.03 | 293.15 |
| IM14 | PF6 | −2.96 [28] | −2.87 | 0.09 | 293.15 |
| IM14 | PF6 | −2.93 [31] | −2.87 | 0.06 | 294 |
| IM14 | PF6 | −2.87 [29] | −2.87 | 0 | 294.15 |
| IM14 | PF6 | −2.89 [30] | −2.87 | 0.02 | 295 |
| IM14 | PF6 | −2.9 [24] | −2.87 | 0.03 | 296.5 |
| IM14 | PF6 | −2.92 [28] | −2.87 | 0.05 | 298.15 |
| Py3OH | (CF3SO2)2N | −2.43 | −2.83 | −0.4 | 293.15 |
| IM12OH | (CF3SO2)2N | −2.34 [24] | −2.66 | −0.32 | 296.5 |
| IM12 | B(CN)4 | −2.46 [24] | −2.46 | 0 | 296.5 |
| N4444 | (6-2Et)2SS | −1.52 [32] | −1.52 | 0 | 298 |
Cation acronyms explained in Table 1
(6-2Et)-2SS = bis(2-ethylhexyl)sulfosuccinate