Molecule ID: mol2213

SMILES: CCNc1ccc([N+](=O)[O-])cc1

InChI: InChI=1S/C8H10N2O2/c1-2-9-7-3-5-8(6-4-7)10(11)12/h3-6,9H,2H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization