Molecule ID: mol6119

SMILES: CCC(N)c1cccc(Br)c1

InChI: InChI=1S/C9H12BrN/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,9H,2,11H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization