Base information
| Cat. No. | |
| CAS No. | 766-39-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6O3 |
| Molecular Weight | 126.11 |
| Exact Mass | 126.032 |
| XLogP3 | 0.4062 |
| Mr | 29.853 |
| PSA | 43.37 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1OC(=O)C(=C1C)C |
