Molecule ID: mol2235

SMILES: Oc1cccc2c1CCC2

InChI: InChI=1S/C9H10O/c10-9-6-2-4-7-3-1-5-8(7)9/h2,4,6,10H,1,3,5H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.20 QSARToolbox 0 » -1
10.20 QSARToolbox 0 » -1
10.20 Datawarrior 0 » -1
10.20 OCHEM 0 » -1
10.26 OCHEM 0 » -1
10.32 Organic Oxygen Acids and Nitrogen Bases 0 » -1
10.32 OCHEM 0 » -1
10.32 Hunt 0 » -1
10.32 OCHEM 0 » -1
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Charge States and Microspecies Visualization