Base information
| Cat. No. | |
| CAS No. | 66841-25-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H19Br4NO3 |
| Molecular Weight | 665.007 |
| Exact Mass | 660.81 |
| XLogP3 | 7.46098 |
| Mr | 131.365 |
| PSA | 59.32 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 51 |
| Ring number | 3 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | N#CC(c1cccc(c1)Oc1ccccc1)OC(=O)C1C(C1(C)C)C(C(Br)(Br)Br)Br |