Molecule ID: mol3846

SMILES: CN(C(=O)c1ccccc1)c1cc[n+]([O-])cc1

InChI: InChI=1S/C13H12N2O2/c1-14(12-7-9-15(17)10-8-12)13(16)11-5-3-2-4-6-11/h2-10H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.70 IUPAC digitized pKa 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization