HuagongsheHuagongshe Chemistry Print Report · For research reference only
Aminohydroxy-9,10-anthracenedione
Identifiers & Physical Properties
| CAS No. | 52738-29-1 |
|---|---|
| Molecular formula | C14H9NO3 |
| Average molar mass | 239.23 g/mol |
| Monoisotopic mass | 239.05824315 g/mol |
| SMILES | O=Nc1ccc2c(O)c3ccccc3c(O)c2c1 |
| InChIKey | HFPOCEBXYAIBEN-UHFFFAOYSA-N |
| PubChem CID | 40513 |
| DTXSID | DTXSID20200722 |
Chemical & Physical Properties
| XLogP | 3.1 |
|---|---|
| Topological polar surface area | 69.9 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 0 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 322 |