Base information
| Cat. No. | |
| CAS No. | 1200-55-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12N2O5S |
| Molecular Weight | 248.256 |
| Exact Mass | 248.047 |
| XLogP3 | 0.493 |
| Mr | 56.1039 |
| PSA | 111.28 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COS(=O)(=O)[O-].O/N=C/c1cccc[n+]1C |
