Base information
| Cat. No. | |
| CAS No. | 168555-66-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H19Na2O8P |
| Molecular Weight | 440.292 |
| Exact Mass | 440.061 |
| XLogP3 | 4.2393 |
| Mr | 97.3875 |
| PSA | 119.15 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 47 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | COc1cc(/C=C\c2ccc(c(c2)OP(=O)([O-])[O-])OC)cc(c1OC)OC.[Na+].[Na+] |
