Base information
| Cat. No. | |
| CAS No. | 121-03-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7NO5S |
| Molecular Weight | 217.199 |
| Exact Mass | 217.004 |
| XLogP3 | 2.7539 |
| Mr | 50.0888 |
| PSA | 108.57 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1ccc(c(c1)S(=O)(=O)O)C |
