Base information
| Cat. No. | |
| CAS No. | 1400644-94-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5BrClNO4 |
| Molecular Weight | 294.487 |
| Exact Mass | 292.909 |
| XLogP3 | 3.161 |
| Mr | 59.5188 |
| PSA | 83.12 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)Cc1cc(Br)c(cc1[N+](=O)[O-])Cl |
