ID: | N5242 | |
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Name: | 1-pentanol, 1-ethyl-3-methylimidazolium tris(pentafluoroethyl)trifluorophosphate | |
Description: | 1-pentanol [EMIm]+[FAP]- | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C6F18P.C6H11N2.C5H12O/c7-1(8,9)4(16,17)25(22,23,24,5(18,19)2(10,11)12)6(20,21)3(13,14)15;1-3-8-5-4-7(2)6-8;1-2-3-4-5-6/h;4-6H,3H2,1-2H3;6H,2-5H2,1H3/q-1;+1; |
logK: Gas-ionic liquid partition coefficient
Value | Source or prediction |
---|---|
3.521954010354649 |
experimental value |
3.697383746418426 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR training predictions) |
3.530873546556173 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF training predictions) |