Base information
| Cat. No. | |
| CAS No. | 27568-04-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13NO4 |
| Molecular Weight | 247.247 |
| Exact Mass | 247.084 |
| XLogP3 | 2.1257 |
| Mr | 66.3445 |
| PSA | 68.65 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1cnc2c(c1O)cccc2OC |
