Base information
| Cat. No. | |
| CAS No. | 208459-81-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H8ClN3 |
| Molecular Weight | 229.665 |
| Exact Mass | 229.041 |
| XLogP3 | 3.2783 |
| Mr | 64.3347 |
| PSA | 41.57 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 26 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Clc1ncnc2c1c(c[nH]2)c1ccccc1 |
