ID: | N5190 | |
---|---|---|
Name: | 3-pentanone, 1-dodecyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide | |
Description: | 3-pentanone [DoMIm]+[(Tf)2N]- | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C16H31N2.C5H10O.C2F6NO4S2/c1-3-4-5-6-7-8-9-10-11-12-13-18-15-14-17(2)16-18;1-3-5(6)4-2;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h14-16H,3-13H2,1-2H3;3-4H2,1-2H3;/q+1;;-1 |
logK: Gas-ionic liquid partition coefficient
Value | Source or prediction |
---|---|
3.498 |
experimental value |
2.935855821717877 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR training predictions) |
3.487840796213021 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF training predictions) |