Molecule ID: mol15693
SMILES: CC1c2cc(O)ccc2CC1CC(=O)O
InChI: InChI=1S/C12H14O3/c1-7-9(5-12(14)15)4-8-2-3-10(13)6-11(7)8/h2-3,6-7,9,13H,4-5H2,1H3,(H,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.30 | Datawarrior | 0 » -1 |
| 5.30 | OCHEM | 0 » -1 |