Base information
| Cat. No. | |
| CAS No. | 1039020-81-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6ClNO6S |
| Molecular Weight | 279.654 |
| Exact Mass | 278.96 |
| XLogP3 | 2.9129 |
| Mr | 59.6265 |
| PSA | 114.64 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc(ccc1S(=O)(=O)Cl)[N+](=O)[O-] |
