Base information
| Cat. No. | |
| CAS No. | 35025-24-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H6FeO |
| Molecular Weight | 222.02 |
| Exact Mass | 221.977 |
| XLogP3 | 0.6787 |
| Mr | 51.0078 |
| PSA | 20.23 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 29 |
| Ring number | 10 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | C[C@H]([CH-]12C3=C4[Fe+2]5678923(C1=C45)[c-]1c6c8c9c71)O |
