Molecule ID: mol1677
SMILES: CCC(CC)CN(CC[N+]1(C)CCCCC1)c1ccccc1
InChI: InChI=1S/C20H35N2/c1-4-19(5-2)18-21(20-12-8-6-9-13-20)14-17-22(3)15-10-7-11-16-22/h6,8-9,12-13,19H,4-5,7,10-11,14-18H2,1-3H3/q+1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.79 | IUPAC digitized pKa | 2 » 1 |
| 3.79 | Hunt | 2 » 1 |