Base information
| Cat. No. | |
| CAS No. | 12108-13-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H7MnO3 |
| Molecular Weight | 218.088 |
| Exact Mass | 217.978 |
| XLogP3 | 1.2991 |
| Mr | 38.0955 |
| PSA | 0 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C[C]1[CH][CH][CH][CH]1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mn] |
