Base information
| Cat. No. | |
| CAS No. | 161156-01-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13NO5 |
| Molecular Weight | 251.235 |
| Exact Mass | 251.079 |
| XLogP3 | 1.8919 |
| Mr | 64.734 |
| PSA | 80.78 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cc(OC)c(c2c1cc([nH]2)C(=O)O)OC |
