Molecule ID: mol13640

SMILES: COc1cccc[n+]1O

InChI: InChI=1S/C6H8NO2/c1-9-6-4-2-3-5-7(6)8/h2-5,8H,1H3/q+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.23 Datawarrior 1 » 0
1.23 OCHEM 1 » 0
1.23 AttenGpKa training set 1 » 0
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Charge States and Microspecies Visualization