ID: | N1223 | |
---|---|---|
Name: | nonane, 1-(3-hydroxypropyl)pyridinium bis(trifluoromethylsulfonyl)imide | |
Description: | nonane [1-PrOHPy]+[(Tf)2N]- | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C9H20.C8H12NO.C2F6NO4S2/c1-3-5-7-9-8-6-4-2;10-8-4-7-9-5-2-1-3-6-9;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h3-9H2,1-2H3;1-3,5-6,10H,4,7-8H2;/q;+1;-1 |
logK: Gas-ionic liquid partition coefficient
Value | Source or prediction |
---|---|
1.82 |
experimental value |
2.089521250988347 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR training predictions) |
1.788036440994924 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF training predictions) |