Molecule ID: mol3581
SMILES: CC1CCCCN1
InChI: InChI=1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.09 | IUPAC digitized pKa | 1 » 0 |
| 10.92 | IUPAC digitized pKa | 1 » 0 |
| 10.95 | IUPAC digitized pKa | 1 » 0 |
| 10.98 | Datawarrior | 1 » 0 |
| 10.98 | OCHEM | 1 » 0 |
| 10.98 | AttenGpKa training set | 1 » 0 |
| 11.02 | OCHEM | 1 » 0 |
| 11.02 | IUPAC digitized pKa | 1 » 0 |
| 11.08 | IUPAC digitized pKa | 1 » 0 |
| 11.08 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 11.08 | OCHEM | 1 » 0 |