Base information
| Cat. No. | |
| CAS No. | 17090-71-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4O3 |
| Molecular Weight | 124.094 |
| Exact Mass | 124.016 |
| XLogP3 | 0.6612 |
| Mr | 29.1025 |
| PSA | 47.28 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 13 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=CC(=O)c1ccco1 |
