Base information
| Cat. No. | |
| CAS No. | 12093-05-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H8FeO3 |
| Molecular Weight | 244.024 |
| Exact Mass | 243.982 |
| XLogP3 | 2.1098 |
| Mr | 48.3485 |
| PSA | 0 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C1=CC=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe] |
