Base information
| Cat. No. | |
| CAS No. | 77458-30-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H7ClN2O |
| Molecular Weight | 194.618 |
| Exact Mass | 194.025 |
| XLogP3 | 2.2313 |
| Mr | 50.597 |
| PSA | 38.05 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc(cc1)n1ncc(c1)O |
