Molecule ID: mol1927
SMILES: O=C(O)C(Cl)Cl
InChI: InChI=1S/C2H2Cl2O2/c3-1(4)2(5)6/h1H,(H,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.26 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 1.26 | OCHEM | 0 » -1 |
| 1.26 | OCHEM | 0 » -1 |
| 1.26 | OCHEM | 0 » -1 |
| 1.26 | Hunt | 0 » -1 |
| 1.26 | OCHEM | 0 » -1 |
| 1.26 | OCHEM | 0 » -1 |
| 1.26 | OCHEM | 0 » -1 |
| 1.26 | OCHEM | 0 » -1 |
| 1.29 | QSARToolbox | 0 » -1 |
| 1.29 | QSARToolbox | 0 » -1 |
| 1.30 | QSARToolbox | 0 » -1 |
| 1.30 | QSARToolbox | 0 » -1 |
| 1.30 | QSARToolbox | 0 » -1 |
| 1.30 | QSARToolbox | 0 » -1 |
| 1.30 | QSARToolbox | 0 » -1 |
| 1.30 | IUPAC digitized pKa | 0 » -1 |
| 1.31 | IUPAC digitized pKa | 0 » -1 |
| 1.32 | QSARToolbox | 0 » -1 |
| 1.32 | QSARToolbox | 0 » -1 |
| 1.33 | IUPAC digitized pKa | 0 » -1 |
| 1.34 | AttenGpKa training set | 0 » -1 |
| 1.35 | IUPAC digitized pKa | 0 » -1 |
| 1.35 | QSARToolbox | 0 » -1 |
| 1.35 | QSARToolbox | 0 » -1 |
| 1.36 | OCHEM | 0 » -1 |
| 1.36 | QSARToolbox | 0 » -1 |
| 1.36 | QSARToolbox | 0 » -1 |
| 1.38 | IUPAC digitized pKa | 0 » -1 |
| 1.40 | IUPAC digitized pKa | 0 » -1 |
| 1.42 | IUPAC digitized pKa | 0 » -1 |
| 1.44 | IUPAC digitized pKa | 0 » -1 |
| 1.45 | IUPAC digitized pKa | 0 » -1 |
| 1.48 | QSARToolbox | 0 » -1 |
| 1.48 | QSARToolbox | 0 » -1 |
| 1.48 | QSARToolbox | 0 » -1 |
| 2.77 | QSARToolbox | 0 » -1 |
| 2.77 | QSARToolbox | 0 » -1 |