Molecule ID: mol6324

SMILES: COc1cccc(N)cc1=O

InChI: InChI=1S/C8H9NO2/c1-11-8-4-2-3-6(9)5-7(8)10/h2-5H,9H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.08 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization