Molecule ID: mol2217

SMILES: CC(C)Nc1ccccc1[N+](=O)[O-]

InChI: InChI=1S/C9H12N2O2/c1-7(2)10-8-5-3-4-6-9(8)11(12)13/h3-7,10H,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization