Molecule ID: mol9498

SMILES: O=[N+]([O-])C(CCCC(Cl)(Cl)Cl)[N+](=O)[O-]

InChI: InChI=1S/C5H7Cl3N2O4/c6-5(7,8)3-1-2-4(9(11)12)10(13)14/h4H,1-3H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.79 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization