Molecule ID: mol6330
SMILES: NCCC1CCCCN1
InChI: InChI=1S/C7H16N2/c8-5-4-7-3-1-2-6-9-7/h7,9H,1-6,8H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.81 | IUPAC digitized pKa | 2 » 1 |
| 8.07 | IUPAC digitized pKa | 2 » 1 |
| 8.33 | IUPAC digitized pKa | 2 » 1 |
| 8.79 | IUPAC digitized pKa | 2 » 1 |
| 9.87 | IUPAC digitized pKa | 1 » 0 |
| 10.10 | IUPAC digitized pKa | 1 » 0 |
| 10.37 | IUPAC digitized pKa | 1 » 0 |
| 10.78 | IUPAC digitized pKa | 1 » 0 |