Base information
| Cat. No. | |
| CAS No. | 1261170-79-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8O3 |
| Molecular Weight | 167.136 |
| Exact Mass | 167.057 |
| XLogP3 | 1.49 |
| Mr | 45.1348 |
| PSA | 57.53 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O[13C](=O)/[13CH]=[13CH]/c1cccc(c1)O |
