Base information
| Cat. No. | |
| CAS No. | 1000890-01-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H12BrClO2 |
| Molecular Weight | 351.622 |
| Exact Mass | 349.971 |
| XLogP3 | 5.1982 |
| Mr | 86.021 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 33 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC(=O)Oc1ccccc1/C=C/c1cc(Cl)ccc1Br |
