Base information
| Cat. No. | |
| CAS No. | 496835-91-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H6BrN |
| Molecular Weight | 232.076 |
| Exact Mass | 230.968 |
| XLogP3 | 3.47398 |
| Mr | 56.363 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cc(Br)c2c(c1)cccc2 |
