HuagongsheHuagongshe Chemistry Print Report · For research reference only
Phenyl 3-methoxyacridan-9-carboxylate
Identifiers & Physical Properties
| Molecular formula | C21H17NO3 |
|---|---|
| Average molar mass | 331.4 g/mol |
| Monoisotopic mass | 331.1208434 g/mol |
| SMILES | COc1ccc2c(c1)Nc1ccccc1C2C(=O)Oc1ccccc1 |
| InChIKey | BPHUTWPLTMHZRB-UHFFFAOYSA-N |
| PubChem CID | 69964118 |
Chemical & Physical Properties
| XLogP | 4.6 |
|---|---|
| Topological polar surface area | 47.6 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 4 |
| Heavy atoms | 25 |
| Formal charge | 0 |
| Complexity | 462 |