Molecule ID: mol7575

SMILES: CC(C)(C)Cc1nccs1

InChI: InChI=1S/C8H13NS/c1-8(2,3)6-7-9-4-5-10-7/h4-5H,6H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization