Base information
| Cat. No. | |
| CAS No. | 596-03-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H6Br2O5 |
| Molecular Weight | 486.067 |
| Exact Mass | 483.858 |
| XLogP3 | 3.9244 |
| Mr | 99.4016 |
| PSA | 75.99 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 37 |
| Ring number | 5 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | BrC1=C(O)[C]=CC2=C1OC1=C(C32OC(=O)C2=C3C=C[C]=[C]2)C=[C]C(=C1Br)O |
