Molecule ID: mol901
SMILES: CCCNCCC
InChI: InChI=1S/C6H15N/c1-3-5-7-6-4-2/h7H,3-6H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.88 | IUPAC digitized pKa | 1 » 0 |
| 10.90 | OCHEM | 1 » 0 |
| 10.91 | OCHEM | 1 » 0 |
| 10.91 | OCHEM | 1 » 0 |
| 10.96 | AttenGpKa training set | 1 » 0 |
| 11.00 | IUPAC digitized pKa | 1 » 0 |
| 11.00 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 11.00 | OCHEM | 1 » 0 |
| 11.00 | OCHEM | 1 » 0 |
| 11.00 | Hunt | 1 » 0 |
| 11.00 | OCHEM | 1 » 0 |
| 11.02 | Datawarrior | 1 » 0 |
| 11.02 | OCHEM | 1 » 0 |