ID: | N5807 | |
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Name: | dodecane, n-cyclohexylmethyl-n-methylpyrrolidinium bis(trifluoromethylsulfonyl)imide | |
Description: | dodecane [ChxMPyrr]+[Tf2N]- | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C12H24N.C12H26.C2F6NO4S2/c1-13(9-5-6-10-13)11-12-7-3-2-4-8-12;1-3-5-7-9-11-12-10-8-6-4-2;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h12H,2-11H2,1H3;3-12H2,1-2H3;/q+1;;-1 |
logK: Gas-ionic liquid partition coefficient
Value | Source or prediction |
---|---|
3.819 |
experimental value |
3.391697399925964 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR training predictions) |
3.913167614455812 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF training predictions) |