Base information
| Cat. No. | |
| CAS No. | 178432-25-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12BNO4S |
| Molecular Weight | 229.061 |
| Exact Mass | 229.058 |
| XLogP3 | -0.3025 |
| Mr | 57.0646 |
| PSA | 86.22 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OB(c1ccccc1S(=O)(=O)N(C)C)O |
