Base information
| Cat. No. | |
| CAS No. | 71774-49-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9ClN2O |
| Molecular Weight | 172.612 |
| Exact Mass | 172.04 |
| XLogP3 | 0.5728 |
| Mr | 47.4585 |
| PSA | 47.32 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O[C@@]12C[C@@H](CN2C(=N)C=C1)Cl |