Molecule ID: mol2216

SMILES: Nc1ccccc1C=O

InChI: InChI=1S/C7H7NO/c8-7-4-2-1-3-6(7)5-9/h1-5H,8H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization