Molecule ID: mol35824

SMILES: CCNCCOP(=O)(O)Oc1ccc([N+](=O)[O-])cc1Cl

InChI: InChI=1S/C10H14ClN2O6P/c1-2-12-5-6-18-20(16,17)19-10-4-3-8(13(14)15)7-9(10)11/h3-4,7,12H,2,5-6H2,1H3,(H,16,17)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.40 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization