Base information
| Cat. No. | |
| CAS No. | 80789-76-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H14NNaO5S |
| Molecular Weight | 295.287 |
| Exact Mass | 295.049 |
| XLogP3 | 3.0092 |
| Mr | 67.0606 |
| PSA | 94.1 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOc1ccc(c2c1nccc2)S(=O)(=O)O.[NaH].O |
