Molecule ID: mol11633
SMILES: O=C(O)CCCCCCCCCCP(=O)(O)O
InChI: InChI=1S/C11H23O5P/c12-11(13)9-7-5-3-1-2-4-6-8-10-17(14,15)16/h1-10H2,(H,12,13)(H2,14,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.00 | IUPAC digitized pKa | -1 » -2 |
| 8.25 | IUPAC digitized pKa | -2 » -3 |
| 8.25 | AttenGpKa training set | -2 » -3 |