Molecule ID: mol36767
SMILES: O=P(O)(O)Cc1cccc(C(O)P(=O)(O)O)c1
InChI: InChI=1S/C8H12O7P2/c9-8(17(13,14)15)7-3-1-2-6(4-7)5-16(10,11)12/h1-4,8-9H,5H2,(H2,10,11,12)(H2,13,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.98 | QSARToolbox | -2 » -3 |
| 7.29 | QSARToolbox | -2 » -3 |