Base information
| Cat. No. | |
| CAS No. | 116-82-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H8BrNO3 |
| Molecular Weight | 318.122 |
| Exact Mass | 316.969 |
| XLogP3 | 3.0935 |
| Mr | 73.8764 |
| PSA | 80.39 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 29 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Oc1cc(Br)c(c2c1C(=O)c1ccccc1C2=O)N |
