Molecule ID: mol36374

SMILES: O=C(O)c1cc([N+](=O)[O-])ccc1S(=O)(=O)c1ccc(Cl)cc1

InChI: InChI=1S/C13H8ClNO6S/c14-8-1-4-10(5-2-8)22(20,21)12-6-3-9(15(18)19)7-11(12)13(16)17/h1-7H,(H,16,17)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
1.92 QSARToolbox 0 » -1
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Charge States and Microspecies Visualization