Molecule ID: mol32307

SMILES: C=C(C)C=C(C(=O)O)c1ccc([N+](=O)[O-])cc1

InChI: InChI=1S/C12H11NO4/c1-8(2)7-11(12(14)15)9-3-5-10(6-4-9)13(16)17/h3-7H,1H2,2H3,(H,14,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization