Molecule ID: mol6332
SMILES: O=C(O)CN1CCCCC1
InChI: InChI=1S/C7H13NO2/c9-7(10)6-8-4-2-1-3-5-8/h1-6H2,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.98 | IUPAC digitized pKa | 1 » 0 |
| 2.13 | IUPAC digitized pKa | 1 » 0 |
| 10.20 | IUPAC digitized pKa | 0 » -1 |
| 10.25 | IUPAC digitized pKa | 0 » -1 |
| 10.35 | Datawarrior | 0 » -1 |
| 10.35 | OCHEM | 0 » -1 |