HuagongsheHuagongshe Chemistry Print Report · For research reference only
1H-2-Benzopyran-1-one, 6,7-dimethoxy-3-propyl-
Identifiers & Physical Properties
| CAS No. | 173414-65-8 |
|---|---|
| Molecular formula | C14H16O4 |
| Average molar mass | 248.27 g/mol |
| Monoisotopic mass | 248.10485899 g/mol |
| SMILES | CCCc1cc2cc(OC)c(OC)cc2c(=O)o1 |
| InChIKey | IMMHGQJHZJUHCF-UHFFFAOYSA-N |
| PubChem CID | 11831782 |
| DTXSID | DTXSID60474162 |
Chemical & Physical Properties
| XLogP | 3 |
|---|---|
| Topological polar surface area | 44.8 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 4 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 337 |