Base information
| Cat. No. | |
| CAS No. | 33725-54-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H15FeO9 |
| Molecular Weight | 431.151 |
| Exact Mass | 431.007 |
| XLogP3 | 2.2817 |
| Mr | 86.4255 |
| PSA | 130.11 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 48 |
| Ring number | 6 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | CC1=C2[O-][Fe+3]34([O]=C2C=CO1)([O]=C1C(=C(C)OC=C1)[O-]4)[O]=C1C(=C(C)OC=C1)[O-]3 |
