Molecule ID: mol738
SMILES: O=C(O)c1cc(I)cc(I)c1O
InChI: InChI=1S/C7H4I2O3/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2,10H,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.27 | IUPAC digitized pKa | 0 » -1 |
| 2.28 | IUPAC digitized pKa | 0 » -1 |
| 2.29 | IUPAC digitized pKa | 0 » -1 |
| 2.30 | IUPAC digitized pKa | 0 » -1 |
| 2.30 | OCHEM | 0 » -1 |
| 2.30 | OCHEM | 0 » -1 |
| 2.30 | OCHEM | 0 » -1 |
| 2.30 | OCHEM | 0 » -1 |
| 2.30 | QSARToolbox | 0 » -1 |
| 2.30 | QSARToolbox | 0 » -1 |
| 2.30 | QSARToolbox | 0 » -1 |
| 2.30 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 2.30 | OCHEM | 0 » -1 |
| 2.30 | Hunt | 0 » -1 |
| 2.33 | OCHEM | 0 » -1 |
| 2.33 | Baltruschat ChEMBL | 0 » -1 |
| 5.47 | OCHEM | 0 » -1 |
| 5.47 | Baltruschat ChEMBL | 0 » -1 |