Base information
| Cat. No. | |
| CAS No. | 72678-96-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H11NO4S |
| Molecular Weight | 253.274 |
| Exact Mass | 253.041 |
| XLogP3 | 1.5323 |
| Mr | 65.8575 |
| PSA | 93.09 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C1CSC(N1)c1ccc2c(c1)OCO2 |
