Base information
| Cat. No. | |
| CAS No. | 100900-07-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13N2NaO3S |
| Molecular Weight | 288.298 |
| Exact Mass | 288.054 |
| XLogP3 | 2.9686 |
| Mr | 68.7755 |
| PSA | 103.63 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | NCCNc1cccc2c1cccc2S(=O)(=O)[O-].[Na+] |
