ID: | N55 | |
---|---|---|
Name: | 1-Octylquinuclidinium | |
Description: | [Quin8]+ | |
Labels: | ||
CAS: | ||
InChi Code: | InChI=1S/C15H30N/c1-2-3-4-5-6-7-11-16-12-8-15(9-13-16)10-14-16/h15H,2-14H2,1H3/q+1 |
logKh: Gas-ionic liquid partition coefficient of hexane in [Tf2N]- ionic liquids
Value | Source or prediction |
---|---|
1.838 |
experimental value |
1.79098905093486 |
SVRh: Support Vector Regression model for logK of hexane in [Tf2N]- ionic liquids (Training set) |
1.716290592932073 |
MLRh-Eq23: Multiple Linear Regression model for logK of hexane in [Tf2N]- ionic liquids (Training set) |
logKc: Gas-ionic liquid partition coefficient of cyclohexane in [Tf2N]- ionic liquids
Value | Source or prediction |
---|---|
2.187 |
experimental value |
2.087490540513675 |
MLRc-Eq24: Multiple Linear Regression model for logK of cyclohexane in [Tf2N]- ionic liquids (Training set) |
2.148883523503395 |
SVRc: Support Vector Regression model for logK of cyclohexane in [Tf2N]- ionic liquids (Training set) |
logKb: Gas-ionic liquid partition coefficient of benzene in [Tf2N]- ionic liquids
Value | Source or prediction |
---|---|
2.979 |
experimental value |
2.907904911999722 |
MLRb-Eq25: Multiple Linear Regression model for logK of benzene in [Tf2N]- ionic liquids (Training set) |
2.978325646060715 |
SVRb: Support Vector Regression model for logK of benzene in [Tf2N]- ionic liquids (Training set) |