Base information
| Cat. No. | |
| CAS No. | 5876-17-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H11NO4 |
| Molecular Weight | 245.231 |
| Exact Mass | 245.069 |
| XLogP3 | 2.7038 |
| Mr | 66.522 |
| PSA | 64.72 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 31 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1c(O)ccc2c1nc1occc1c2OC |
