Molecule ID: mol12587

SMILES: NC(=O)C(=NO)c1ccccc1

InChI: InChI=1S/C8H8N2O2/c9-8(11)7(10-12)6-4-2-1-3-5-6/h1-5,12H,(H2,9,11)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.55 Datawarrior 0 » -1
9.82 OCHEM 0 » -1
10.10 Datawarrior 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization