Molecule ID: mol9823
SMILES: O=P(O)(O)C1CCCCC1
InChI: InChI=1S/C6H13O3P/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2,(H2,7,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.20 | IUPAC digitized pKa | 0 » -1 |
| 2.20 | QSARToolbox | 0 » -1 |
| 8.30 | IUPAC digitized pKa | -1 » -2 |
| 8.30 | QSARToolbox | -1 » -2 |