Molecule ID: mol11378

SMILES: CCOc1ccccc1[Se]CC(=O)O

InChI: InChI=1S/C10H12O3Se/c1-2-13-8-5-3-4-6-9(8)14-7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization