Molecule ID: mol230
SMILES: CC(=O)OCCCN(C)C
InChI: InChI=1S/C7H15NO2/c1-7(9)10-6-4-5-8(2)3/h4-6H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.00 | IUPAC digitized pKa | 1 » 0 |
| 9.00 | OCHEM | 1 » 0 |
| 9.00 | OCHEM | 1 » 0 |
| 9.00 | Hunt | 1 » 0 |
| 9.00 | AvLiLuMoVe | 1 » 0 |
| 9.00 | Settimo | 1 » 0 |
| 9.00 | AttenGpKa training set | 1 » 0 |