Base information
| Cat. No. | |
| CAS No. | 1217739-51-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H15ClN2O4 |
| Molecular Weight | 286.712 |
| Exact Mass | 286.072 |
| XLogP3 | 2.9981 |
| Mr | 77.6425 |
| PSA | 95.15 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 34 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@@]1(CCCN1)Cc1ccc(cc1)[N+](=O)[O-].Cl |
