Molecule ID: mol11556

SMILES: O=c1nc(Cc2ccccc2)[nH]c(O)c1[N+](=O)[O-]

InChI: InChI=1S/C11H9N3O4/c15-10-9(14(17)18)11(16)13-8(12-10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,12,13,15,16)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization