Molecule ID: mol188
SMILES: CCCN(C)C
InChI: InChI=1S/C5H13N/c1-4-5-6(2)3/h4-5H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.17 | IUPAC digitized pKa | 1 » 0 |
| 9.62 | OCHEM | 1 » 0 |
| 9.62 | Datawarrior | 1 » 0 |
| 9.67 | OCHEM | 1 » 0 |
| 9.99 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 10.08 | AttenGpKa training set | 1 » 0 |
| 10.16 | IUPAC digitized pKa | 1 » 0 |
| 10.20 | OCHEM | 1 » 0 |
| 10.20 | OCHEM | 1 » 0 |
| 10.20 | Hunt | 1 » 0 |
| 10.20 | Settimo | 1 » 0 |