Molecule ID: mol5886
SMILES: CCN(CCO)CC(C)O
InChI: InChI=1S/C7H17NO2/c1-3-8(4-5-9)6-7(2)10/h7,9-10H,3-6H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.10 | IUPAC digitized pKa | 1 » 0 |
| 8.40 | IUPAC digitized pKa | 1 » 0 |
| 8.45 | IUPAC digitized pKa | 1 » 0 |
| 8.75 | IUPAC digitized pKa | 1 » 0 |
| 8.90 | OCHEM | 1 » 0 |
| 8.90 | QSARToolbox | 1 » 0 |
| 8.90 | IUPAC digitized pKa | 1 » 0 |
| 8.90 | Datawarrior | 1 » 0 |