Molecule ID: mol1772
SMILES: O=CC(=O)O
InChI: InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.26 | Datawarrior | 0 » -1 |
| 1.26 | OCHEM | 0 » -1 |
| 2.46 | OCHEM | 0 » -1 |
| 2.46 | OCHEM | 0 » -1 |
| 2.98 | IUPAC digitized pKa | 0 » -1 |
| 3.08 | OCHEM | 0 » -1 |
| 3.18 | IUPAC digitized pKa | 0 » -1 |
| 3.18 | OCHEM | 0 » -1 |
| 3.18 | Hunt | 0 » -1 |
| 3.18 | QSARToolbox | 0 » -1 |
| 3.19 | AttenGpKa training set | 0 » -1 |
| 3.30 | QSARToolbox | 0 » -1 |
| 3.30 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 3.32 | QSARToolbox | 0 » -1 |
| 3.46 | IUPAC digitized pKa | 0 » -1 |