Base information
| Cat. No. | |
| CAS No. | 25785-09-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H9NO4S |
| Molecular Weight | 251.258 |
| Exact Mass | 251.025 |
| XLogP3 | 3.5094 |
| Mr | 66.7335 |
| PSA | 100.36 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1cc2c(s1)ccc(c2)[N+](=O)[O-] |
