Molecule ID: mol11015
SMILES: Cc1cccc([Se]CC(=O)O)c1
InChI: InChI=1S/C9H10O2Se/c1-7-3-2-4-8(5-7)12-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.78 | QSARToolbox | 0 » -1 |
| 3.78 | IUPAC digitized pKa | 0 » -1 |
| 3.78 | Datawarrior | 0 » -1 |
| 3.78 | OCHEM | 0 » -1 |