Base information
| Cat. No. | |
| CAS No. | 30186-40-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H8BrNO |
| Molecular Weight | 250.091 |
| Exact Mass | 248.979 |
| XLogP3 | 3.0523 |
| Mr | 58.8565 |
| PSA | 22 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1cccn1c1ccc(cc1)Br |
