Molecule ID: mol11487

SMILES: CC(=O)C1C(=O)c2ccccc2C1=O

InChI: InChI=1S/C11H8O3/c1-6(12)9-10(13)7-4-2-3-5-8(7)11(9)14/h2-5,9H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.88 Datawarrior 0 » -1
2.88 AttenGpKa training set 0 » -1
2.88 OCHEM 0 » -1
2.88 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization