Molecule ID: mol1767
SMILES: O=C(O)C(F)F
InChI: InChI=1S/C2H2F2O2/c3-1(4)2(5)6/h1H,(H,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.13 | QSARToolbox | 0 » -1 |
| 1.13 | IUPAC digitized pKa | 0 » -1 |
| 1.24 | OCHEM | 0 » -1 |
| 1.24 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 1.24 | Baltruschat ChEMBL | 0 » -1 |
| 1.29 | IUPAC digitized pKa | 0 » -1 |
| 1.30 | QSARToolbox | 0 » -1 |
| 1.30 | QSARToolbox | 0 » -1 |
| 1.30 | QSARToolbox | 0 » -1 |
| 1.31 | IUPAC digitized pKa | 0 » -1 |
| 1.33 | OCHEM | 0 » -1 |
| 1.33 | OCHEM | 0 » -1 |
| 1.33 | Hunt | 0 » -1 |
| 1.33 | OCHEM | 0 » -1 |
| 1.34 | IUPAC digitized pKa | 0 » -1 |
| 1.34 | AttenGpKa training set | 0 » -1 |
| 1.34 | QSARToolbox | 0 » -1 |
| 1.37 | IUPAC digitized pKa | 0 » -1 |
| 1.39 | IUPAC digitized pKa | 0 » -1 |
| 1.41 | IUPAC digitized pKa | 0 » -1 |
| 1.43 | IUPAC digitized pKa | 0 » -1 |
| 1.46 | IUPAC digitized pKa | 0 » -1 |
| 2.72 | QSARToolbox | 0 » -1 |