Molecule ID: mol1542

SMILES: Cc1cccc(CN(CCO)CCO)c1

InChI: InChI=1S/C12H19NO2/c1-11-3-2-4-12(9-11)10-13(5-7-14)6-8-15/h2-4,9,14-15H,5-8,10H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.00 IUPAC digitized pKa 1 » 0
7.00 Hunt 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization