Molecule ID: mol13077

SMILES: NOCc1ccc(Cl)cc1

InChI: InChI=1S/C7H8ClNO/c8-7-3-1-6(2-4-7)5-10-9/h1-4H,5,9H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization