Base information
| Cat. No. | |
| CAS No. | 106896-57-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11NO3 |
| Molecular Weight | 217.221 |
| Exact Mass | 217.074 |
| XLogP3 | 2.1571 |
| Mr | 59.7727 |
| PSA | 59.16 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cccc2c1c(c[nH]2)C(=O)C |
