Base information
| Cat. No. | |
| CAS No. | 122-14-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12NO5PS |
| Molecular Weight | 277.234 |
| Exact Mass | 277.017 |
| XLogP3 | 3.9731 |
| Mr | 69.267 |
| PSA | 115.41 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COP(=S)(Oc1ccc(c(c1)C)[N+](=O)[O-])OC |
