Base information
| Cat. No. | |
| CAS No. | 179863-07-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H14N2O5S |
| Molecular Weight | 262.283 |
| Exact Mass | 262.062 |
| XLogP3 | 0.7959 |
| Mr | 61.6381 |
| PSA | 114.86 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=c1oc2n(c1[nH+]c2)C.CCCCS(=O)(=O)[O-] |
