Base information
| Cat. No. | |
| CAS No. | 1167055-37-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6ClNO |
| Molecular Weight | 179.603 |
| Exact Mass | 179.014 |
| XLogP3 | 2.6338 |
| Mr | 48.6962 |
| PSA | 32.86 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=Cc1ccc(c2c1cc[nH]2)Cl |
