Molecule ID: mol14329

SMILES: C[N+]1(CCCCCC(=O)O)CCCCC1

InChI: InChI=1S/C12H23NO2/c1-13(10-6-3-7-11-13)9-5-2-4-8-12(14)15/h2-11H2,1H3/p+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
4.44 Datawarrior 1 » 0
4.44 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization