ID: | N4917 | |
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Name: | 1-butanol, 1,3-didecyl-2-methylimidazolium bis(trifluoromethylsulfonyl)imide | |
Description: | 1-butanol [D2MIm]+[(Tf)2N]- | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C24H47N2.C4H10O.C2F6NO4S2/c1-4-6-8-10-12-14-16-18-20-25-22-23-26(24(25)3)21-19-17-15-13-11-9-7-5-2;1-2-3-4-5;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h22-23H,4-21H2,1-3H3;5H,2-4H2,1H3;/q+1;;-1 |
logK: Gas-ionic liquid partition coefficient
Value | Source or prediction |
---|---|
3.39181638744439 |
experimental value |
3.604790419874957 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR training predictions) |
3.386704069962923 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF training predictions) |