Molecule ID: mol31183

SMILES: OC1(c2ccccc2)OCCO1

InChI: InChI=1S/C9H10O3/c10-9(11-6-7-12-9)8-4-2-1-3-5-8/h1-5,10H,6-7H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
11.33 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization