Molecule ID: mol3465
SMILES: CC(C)NCC(O)c1ccc(O)cc1
InChI: InChI=1S/C11H17NO2/c1-8(2)12-7-11(14)9-3-5-10(13)6-4-9/h3-6,8,11-14H,7H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.03 | IUPAC digitized pKa | 1 » 0 |
| 9.17 | IUPAC digitized pKa | 1 » 0 |
| 9.57 | IUPAC digitized pKa | 0 » -1 |
| 9.57 | OCHEM | 0 » -1 |
| 9.78 | IUPAC digitized pKa | 0 » -1 |
| 10.18 | IUPAC digitized pKa | 0 » -1 |
| 10.25 | IUPAC digitized pKa | 0 » -1 |