Molecule ID: mol3193
SMILES: CN(C)CCCN(C)CCCN(C)C
InChI: InChI=1S/C11H27N3/c1-12(2)8-6-10-14(5)11-7-9-13(3)4/h6-11H2,1-5H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.40 | Datawarrior | 3 » 2 |
| 6.40 | OCHEM | 3 » 2 |
| 7.40 | IUPAC digitized pKa | 3 » 2 |
| 9.00 | IUPAC digitized pKa | 2 » 1 |
| 9.00 | Datawarrior | 2 » 1 |
| 9.70 | OCHEM | 1 » 0 |
| 9.70 | OCHEM | 1 » 0 |
| 10.00 | IUPAC digitized pKa | 1 » 0 |
| 10.00 | Datawarrior | 1 » 0 |
| 10.00 | OCHEM | 1 » 0 |