Base information
| Cat. No. | |
| CAS No. | 42951-71-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6BrClN2 |
| Molecular Weight | 245.504 |
| Exact Mass | 243.94 |
| XLogP3 | 2.98598 |
| Mr | 51.594 |
| PSA | 36.68 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1c(Cl)nc(c(c1C)Br)C |
