Molecule ID: mol2038
SMILES: CC(C)(N)CO
InChI: InChI=1S/C4H11NO/c1-4(2,5)3-6/h6H,3,5H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.71 | IUPAC digitized pKa | 1 » 0 |
| 8.96 | IUPAC digitized pKa | 1 » 0 |
| 9.24 | IUPAC digitized pKa | 1 » 0 |
| 9.54 | IUPAC digitized pKa | 1 » 0 |
| 9.65 | IUPAC digitized pKa | 1 » 0 |
| 9.65 | AttenGpKa training set | 1 » 0 |
| 9.71 | IUPAC digitized pKa | 1 » 0 |
| 9.71 | OCHEM | 1 » 0 |
| 9.71 | Hunt | 1 » 0 |
| 9.72 | OCHEM | 1 » 0 |
| 9.72 | IUPAC digitized pKa | 1 » 0 |
| 9.74 | OCHEM | 1 » 0 |
| 9.74 | Datawarrior | 1 » 0 |
| 9.85 | IUPAC digitized pKa | 1 » 0 |
| 9.85 | OCHEM | 1 » 0 |
| 9.96 | OCHEM | 1 » 0 |
| 9.96 | OCHEM | 1 » 0 |
| 10.19 | IUPAC digitized pKa | 1 » 0 |
| 10.19 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 10.56 | IUPAC digitized pKa | 1 » 0 |