Base information
| Cat. No. | |
| CAS No. | 370100-64-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H16BrClNNaO8 |
| Molecular Weight | 464.626 |
| Exact Mass | 462.965 |
| XLogP3 | 0.903 |
| Mr | 89.9237 |
| PSA | 141.47 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 42 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@H]1O[C@@H](Oc2c[nH]c3c2c(Cl)c(cc3)Br)[C@@H]([C@H]([C@@H]1O)O)O.[NaH].O |
