Base information
| Cat. No. | |
| CAS No. | 40003-41-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H4BrNO2S |
| Molecular Weight | 222.06 |
| Exact Mass | 220.915 |
| XLogP3 | 1.9122 |
| Mr | 41.7393 |
| PSA | 78.43 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1nc(c(s1)C(=O)O)C |
