ID: | N1889 | |
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Name: | triethylamine, 1,2,3-tris(diethylamino)cyclopropenylium bis(trifluoromethylsulfonyl)imide | |
Description: | triethylamine [TDC]+[Tf2N]- | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C15H30N3.C6H15N.C2F6NO4S2/c1-7-16(8-2)13-14(17(9-3)10-4)15(13)18(11-5)12-6;1-4-7(5-2)6-3;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h7-12H2,1-6H3;4-6H2,1-3H3;/q+1;;-1 |
logK: Gas-ionic liquid partition coefficient
Value | Source or prediction |
---|---|
2.196393003411502 |
experimental value |
2.714843978870714 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR training predictions) |
2.209816866347999 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF training predictions) |