Base information
| Cat. No. | |
| CAS No. | 76693-35-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H4BrNO2 |
| Molecular Weight | 250.048 |
| Exact Mass | 248.943 |
| XLogP3 | 2.42718 |
| Mr | 54.899 |
| PSA | 54 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1cc2cc(C#N)c(=O)oc2cc1 |
