Molecule ID: mol10815

SMILES: CC[N+](CC)(CC)CC(=O)NBr

InChI: InChI=1S/C8H17BrN2O/c1-4-11(5-2,6-3)7-8(12)10-9/h4-7H2,1-3H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization