Molecule ID: mol36772

SMILES: [O-][N+](O)=C(c1ccc(Br)cc1)C(O)c1ccccc1

InChI: InChI=1S/C14H12BrNO3/c15-12-8-6-10(7-9-12)13(16(18)19)14(17)11-4-2-1-3-5-11/h1-9,14,17H,(H,18,19)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization