Base information
| Cat. No. | |
| CAS No. | 148942-72-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H13BrO5 |
| Molecular Weight | 425.229 |
| Exact Mass | 423.995 |
| XLogP3 | 4.5607 |
| Mr | 101.579 |
| PSA | 75.99 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 44 |
| Ring number | 5 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | BrCc1ccc2c(c1)C(=O)OC12c2ccc(cc2Oc2c1ccc(c2)O)O |
