Base information
| Cat. No. | |
| CAS No. | 656238-36-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H12BrN |
| Molecular Weight | 298.177 |
| Exact Mass | 297.015 |
| XLogP3 | 4.62708 |
| Mr | 76.801 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc2-c3c(C(c2c1)(C)C)cc(cc3)Br |
