Molecule ID: mol3165
SMILES: CC(CN(C)C)N(C)C
InChI: InChI=1S/C7H18N2/c1-7(9(4)5)6-8(2)3/h7H,6H2,1-5H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.40 | IUPAC digitized pKa | 2 » 1 |
| 5.40 | Datawarrior | 2 » 1 |
| 5.40 | QSARToolbox | 2 » 1 |
| 9.19 | OCHEM | 1 » 0 |
| 9.19 | OCHEM | 1 » 0 |
| 9.49 | QSARToolbox | 1 » 0 |
| 9.49 | OCHEM | 1 » 0 |
| 9.49 | IUPAC digitized pKa | 1 » 0 |
| 9.49 | Datawarrior | 1 » 0 |