Molecule ID: mol1707

SMILES: CCCN(CC[N+]1(C)CCCCC1)c1ccccc1

InChI: InChI=1S/C17H29N2/c1-3-12-18(17-10-6-4-7-11-17)13-16-19(2)14-8-5-9-15-19/h4,6-7,10-11H,3,5,8-9,12-16H2,1-2H3/q+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.82 IUPAC digitized pKa 2 » 1
2.82 Hunt 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization