HuagongsheHuagongshe Chemistry Print Report · For research reference only
(3,4-Dimethoxyphenyl)(3,5-dimethoxyphenyl)methanone
Identifiers & Physical Properties
| CAS No. | 116496-27-6 |
|---|---|
| Molecular formula | C17H18O5 |
| Average molar mass | 302.32 g/mol |
| Monoisotopic mass | 302.11542368 g/mol |
| SMILES | COc1cc(OC)cc(C(=O)c2ccc(OC)c(OC)c2)c1 |
| InChIKey | CDGJPOYKKKNYQP-UHFFFAOYSA-N |
| PubChem CID | 21584591 |
| DTXSID | DTXSID20616127 |
Chemical & Physical Properties
| XLogP | 3.4 |
|---|---|
| Topological polar surface area | 54 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 6 |
| Heavy atoms | 22 |
| Formal charge | 0 |
| Complexity | 347 |