Base information
| Cat. No. | |
| CAS No. | 116932-78-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C3H4BrN3O |
| Molecular Weight | 177.987 |
| Exact Mass | 176.954 |
| XLogP3 | 0.6111 |
| Mr | 32.351 |
| PSA | 43.28 |
| Sequence | - |
| Atom number | 12 |
| Bond number | 12 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | [O-][n+]1nn(cc1Br)C |
