Base information
| Cat. No. | |
| CAS No. | 845790-80-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H19BrO3 |
| Molecular Weight | 399.278 |
| Exact Mass | 398.052 |
| XLogP3 | 4.7505 |
| Mr | 102.111 |
| PSA | 38.69 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 46 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COc1cccc(c1)C(c1cccc(c1)OC)(c1cccc(c1)Br)O |
