Base information
| Cat. No. | |
| CAS No. | 1393532-87-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H6BrN3 |
| Molecular Weight | 176.015 |
| Exact Mass | 174.975 |
| XLogP3 | 1.0605 |
| Mr | 33.791 |
| PSA | 30.71 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CCn1cc(nn1)Br |
