HuagongsheHuagongshe Chemistry Print Report · For research reference only
6-(3-methoxyphenyl)thio-2,2,3-trimethyl-2H-benzo[b]pyran
![6-(3-methoxyphenyl)thio-2,2,3-trimethyl-2H-benzo[b]pyran molecular structure](/img/chemical/18782876.png)
Identifiers & Physical Properties
| Molecular formula | C19H20O2S |
|---|---|
| Average molar mass | 312.4 g/mol |
| SMILES | COc1cccc(Sc2ccc3c(c2)C=C(C)C(C)(C)O3)c1 |
| InChIKey | FXVKNECAVLNKMW-UHFFFAOYSA-N |
| PubChem CID | 18782876 |
Chemical & Physical Properties
| XLogP | 4.8 |
|---|---|
| Topological polar surface area | 43.8 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 3 |
| Heavy atoms | 22 |
| Formal charge | 0 |
| Complexity | 418 |