ID: | N1526 | |
---|---|---|
Name: | cyclohexane, 1-butyl-3-methylimidazolium 4,5-dicyano-2-(trifluoromethyl)imidazolide | |
Description: | cyclohexane [BMIm]+[TDI]- | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C8H15N2.C6F3N4.C6H12/c1-3-4-5-10-7-6-9(2)8-10;7-6(8,9)5-12-3(1-10)4(2-11)13-5;1-2-4-6-5-3-1/h6-8H,3-5H2,1-2H3;;1-6H2/q+1;-1; |
logK: Gas-ionic liquid partition coefficient
Value | Source or prediction |
---|---|
1.991 |
experimental value |
2.050264578727887 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR holdout predictions) |
1.901624013798712 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF holdout predictions) |