Base information
| Cat. No. | |
| CAS No. | 528-58-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H11ClO6 |
| Molecular Weight | 322.697 |
| Exact Mass | 322.024 |
| XLogP3 | -0.0871 |
| Mr | 82.025 |
| PSA | 114.29 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 34 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Oc1cc(O)c2c(c1)[o+]c(c(c2)O)c1ccc(c(c1)O)O.[Cl-] |
