Base information
| Cat. No. | |
| CAS No. | 4027-62-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12NNaO3S |
| Molecular Weight | 225.241 |
| Exact Mass | 225.044 |
| XLogP3 | 0.5738 |
| Mr | 53.8658 |
| PSA | 82.91 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@@H]1N2C(=O)C[C@H]2SC1(C)C.[NaH] |
