Base information
| Cat. No. | |
| CAS No. | 1431710-13-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7ClN2O2 |
| Molecular Weight | 198.606 |
| Exact Mass | 198.02 |
| XLogP3 | 1.62388 |
| Mr | 46.946 |
| PSA | 55.14 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1nc(C#N)c(cc1OC)Cl |
