Molecule ID: mol14267

SMILES: Cc1cc([N+](=O)[O-])ccc1O

InChI: InChI=1S/C7H7NO3/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4,9H,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.10 OCHEM 0 » -1
7.10 QSARToolbox 0 » -1
7.10 QSARToolbox 0 » -1
7.10 QSARToolbox 0 » -1
7.10 Datawarrior 0 » -1
7.20 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization