Molecule ID: mol1544

SMILES: Cc1cc(C)c(CN(CCO)CCO)c(C)c1

InChI: InChI=1S/C14H23NO2/c1-11-8-12(2)14(13(3)9-11)10-15(4-6-16)5-7-17/h8-9,16-17H,4-7,10H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization