3,5-O-Dimethylpinosylvin
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL188181 | |
| PubChem: | 5316874 | |
| IUPAC: | 1,3-dimethoxy-5-[(E)-2-phenylethenyl]benzene | |
| Standard InChI: | InChI=1S/C16H16O2/c1-17-15-10-14(11-16(12-15)18-2)9-8-13-6-4-3-5-7-13/h3-12H,1-2H3/b9-8+ | |
| Standard InChI Key: | BIYGTLDPTJMNET-CMDGGOBGSA-N | |
| SMILES: | COc1cc(/C=C/c2ccccc2)cc(c1)OC | |
Molecular propeties
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| AlogP: | 3.87 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 2 | |
| Molecular Weight: | 240.12 | |
| Topological polar surface area: | 18.5 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.125 | |
| Number of carbons: | 16 | |