Egonol
Representations & DB's id
| ||
| ChEBI: | CHEBI:69558 | |
|---|---|---|
| ChEMBL: | CHEMBL470981 | |
| PubChem: | 485186 | |
| IUPAC: | 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propan-1-ol | |
| Standard InChI: | InChI=1S/C19H18O5/c1-21-18-8-12(3-2-6-20)7-14-10-16(24-19(14)18)13-4-5-15-17(9-13)23-11-22-15/h4-5,7-10,20H,2-3,6,11H2,1H3 | |
| Standard InChI Key: | VOLZBKQSLGCZGC-UHFFFAOYSA-N | |
| SMILES: | OCCCc1cc2cc(oc2c(c1)OC)c1ccc2c(c1)OCO2 | |
Molecular propeties
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| AlogP: | 3.76 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 5 | |
| Number of rings: | 4 | |
| Molecular Weight: | 326.12 | |
| Topological polar surface area: | 61.1 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.263 | |
| Number of carbons: | 19 | |