Base information
| Cat. No. | |
| CAS No. | 223787-47-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H12BrNO3 |
| Molecular Weight | 334.165 |
| Exact Mass | 333 |
| XLogP3 | 5.0595 |
| Mr | 84.826 |
| PSA | 55.05 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 33 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(c(c1)[N+](=O)[O-])C=Cc1ccccc1Br |
