Base information
| Cat. No. | |
| CAS No. | 106380-95-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H11NO3 |
| Molecular Weight | 229.231 |
| Exact Mass | 229.074 |
| XLogP3 | 2.444 |
| Mr | 63.8628 |
| PSA | 67.26 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1c(C(=O)C)c(C)nc2c1cccc2 |
