Molecule ID: mol10958

SMILES: O=C1CCc2ccc([N+](=O)[O-])c(O)c21

InChI: InChI=1S/C9H7NO4/c11-7-4-2-5-1-3-6(10(13)14)9(12)8(5)7/h1,3,12H,2,4H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization