Molecule ID: mol10568

SMILES: Cc1c(C(=O)O)cccc1[N+](=O)[O-]

InChI: InChI=1S/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization