Molecule ID: mol11746
SMILES: CCC1(C(C)CC(C)C)C(=O)NC(=O)NC1=O
InChI: InChI=1S/C12H20N2O3/c1-5-12(8(4)6-7(2)3)9(15)13-11(17)14-10(12)16/h7-8H,5-6H2,1-4H3,(H2,13,14,15,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.14 | IUPAC digitized pKa | 0 » -1 |
| 8.14 | OCHEM | 0 » -1 |
| 8.14 | OCHEM | 0 » -1 |
| 8.14 | QSARToolbox | 0 » -1 |