Base information
| Cat. No. | |
| CAS No. | 87657-41-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H14N2O4S |
| Molecular Weight | 282.316 |
| Exact Mass | 282.067 |
| XLogP3 | 2.6966 |
| Mr | 78.565 |
| PSA | 114.16 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 34 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | S[C@H]1CCN(C1)C(=O)OCc1ccc(cc1)[N+](=O)[O-] |
