Base information
| Cat. No. | |
| CAS No. | 31721-95-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6O5 |
| Molecular Weight | 194.141 |
| Exact Mass | 194.022 |
| XLogP3 | 0.9098 |
| Mr | 48.553 |
| PSA | 90.9 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Oc1cc(O)c2c(c1)occ(c2=O)O |
