Base information
| Cat. No. | |
| CAS No. | 80387-79-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H7NO4S |
| Molecular Weight | 249.243 |
| Exact Mass | 249.01 |
| XLogP3 | 3.5447 |
| Mr | 65.5363 |
| PSA | 111.36 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1ccc(cc1)c1ccc(s1)C(=O)O |
