Base information
| Cat. No. | |
| CAS No. | 530-79-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H16BrNNaO6P |
| Molecular Weight | 476.19 |
| Exact Mass | 474.98 |
| XLogP3 | 4.5202 |
| Mr | 106.138 |
| PSA | 114.9 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 45 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1ccccc1NC(=O)c1cc2cc(Br)ccc2cc1OP(=O)(O)O.[NaH] |
