Base information
| Cat. No. | |
| CAS No. | 111614-65-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H25FeNO6 |
| Molecular Weight | 407.239 |
| Exact Mass | 407.103 |
| XLogP3 | 0.2382 |
| Mr | 92.3332 |
| PSA | 118.3 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 49 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | [CH]1[CH][CH][CH][CH]1.O[C@H]([C@H](C(=O)O)O)C(=O)O.C[C@@H]([C]1[CH][CH][CH][CH]1)N(C)C.[Fe] |
