Molecule ID: mol5878
SMILES: CC(O)CN(CCO)C(C)(C)C
InChI: InChI=1S/C9H21NO2/c1-8(12)7-10(5-6-11)9(2,3)4/h8,11-12H,5-7H2,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.20 | IUPAC digitized pKa | 1 » 0 |
| 8.80 | IUPAC digitized pKa | 1 » 0 |
| 9.00 | IUPAC digitized pKa | 1 » 0 |
| 9.20 | OCHEM | 1 » 0 |
| 9.20 | QSARToolbox | 1 » 0 |
| 9.20 | QSARToolbox | 1 » 0 |
| 9.20 | IUPAC digitized pKa | 1 » 0 |
| 9.20 | Datawarrior | 1 » 0 |