Base information
| Cat. No. | |
| CAS No. | 1427475-25-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H4BrN3O2 |
| Molecular Weight | 205.997 |
| Exact Mass | 204.949 |
| XLogP3 | 0.3538 |
| Mr | 35.3622 |
| PSA | 67.87 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1nn[nH]c1Br |
