Molecule ID: mol5935
SMILES: CCCCCCCCN(CCO)CC(C)O
InChI: InChI=1S/C13H29NO2/c1-3-4-5-6-7-8-9-14(10-11-15)12-13(2)16/h13,15-16H,3-12H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.20 | IUPAC digitized pKa | 1 » 0 |
| 7.50 | IUPAC digitized pKa | 1 » 0 |
| 7.80 | IUPAC digitized pKa | 1 » 0 |
| 7.95 | IUPAC digitized pKa | 1 » 0 |
| 8.20 | OCHEM | 1 » 0 |
| 8.20 | QSARToolbox | 1 » 0 |
| 8.20 | QSARToolbox | 1 » 0 |
| 8.20 | Datawarrior | 1 » 0 |