Base information
| Cat. No. | |
| CAS No. | 76-60-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H14Br4O5S |
| Molecular Weight | 698.014 |
| Exact Mass | 693.73 |
| XLogP3 | 7.8562 |
| Mr | 132.301 |
| PSA | 92.21 |
| Sequence | - |
| Atom number | 45 |
| Bond number | 48 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Brc1cc(c(c(c1O)Br)C)C1(OS(=O)(=O)c2c1cccc2)c1cc(Br)c(c(c1C)Br)O |
