ID: | N4724 | |
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Name: | 1-propanol, 1-butyl-1-methylmorpholinium tricyanomethanide | |
Description: | 1-propanol [BMMorp]+[C(CN)3]- | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C9H20NO.C4N3.C3H8O/c1-3-4-5-10(2)6-8-11-9-7-10;5-1-4(2-6)3-7;1-2-3-4/h3-9H2,1-2H3;;4H,2-3H2,1H3/q+1;-1; |
logK: Gas-ionic liquid partition coefficient
Value | Source or prediction |
---|---|
3.318489746841046 |
experimental value |
3.162559763066951 |
MLR: Multiple Linear Regression QSAR model for the gas-ionic liquid partition coefficient of organic solutes (MLR training predictions) |
3.364436612961039 |
RF: Random Forest Regression QSAR model for gas-ionic liquid partition coefficient of organic solutes (RF training predictions) |