HuagongsheHuagongshe Chemistry Print Report · For research reference only
Nimodipine Impurity 38
Identifiers & Physical Properties
| CAS No. | 85677-92-5 |
|---|---|
| Molecular formula | C14H15NO6 |
| Average molar mass | 293.27 g/mol |
| Monoisotopic mass | 293.0899372 g/mol |
| SMILES | COCCOC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)C(C)=O |
| InChIKey | UVZJPCAZMGLNTB-LCYFTJDESA-N |
| PubChem CID | 2304792 |
Chemical & Physical Properties
| XLogP | 1.7 |
|---|---|
| Topological polar surface area | 98.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 7 |
| Heavy atoms | 21 |
| Formal charge | 0 |
| Complexity | 426 |