Molecule ID: mol13056

SMILES: CCOc1cccc[n+]1O

InChI: InChI=1S/C7H10NO2/c1-2-10-7-5-3-4-6-8(7)9/h3-6,9H,2H2,1H3/q+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.18 OCHEM 1 » 0
1.18 Datawarrior 1 » 0
1.18 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization