Base information
| Cat. No. | |
| CAS No. | 661463-17-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5BrFN |
| Molecular Weight | 226.045 |
| Exact Mass | 224.959 |
| XLogP3 | 3.1364 |
| Mr | 49.401 |
| PSA | 12.89 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 18 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Fc1ccc2c(c1)c(Br)ccn2 |
