Molecule ID: mol1363

SMILES: Cc1ccc(O)cc1

InChI: InChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.02 IUPAC digitized pKa 0 » -1
10.10 IUPAC digitized pKa 0 » -1
10.12 IUPAC digitized pKa 0 » -1
10.14 OCHEM 0 » -1
10.21 IUPAC digitized pKa 0 » -1
10.22 Datawarrior 0 » -1
10.22 OCHEM 0 » -1
10.26 IUPAC digitized pKa 0 » -1
10.26 Organic Oxygen Acids and Nitrogen Bases 0 » -1
10.26 OCHEM 0 » -1
10.26 OCHEM 0 » -1
10.26 Hunt 0 » -1
10.26 OCHEM 0 » -1
10.26 OCHEM 0 » -1
10.27 OCHEM 0 » -1
10.27 IUPAC digitized pKa 0 » -1
10.28 IUPAC digitized pKa 0 » -1
10.28 OCHEM 0 » -1
10.28 OCHEM 0 » -1
10.30 IUPAC digitized pKa 0 » -1
10.30 OCHEM 0 » -1
10.30 Baltruschat ChEMBL 0 » -1
10.30 QSARToolbox 0 » -1
10.35 IUPAC digitized pKa 0 » -1
10.42 IUPAC digitized pKa 0 » -1
10.50 IUPAC digitized pKa 0 » -1
10.60 IUPAC digitized pKa 0 » -1
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Charge States and Microspecies Visualization