6-(2H-1,3-benzodioxol-5-yl)-8-ethoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one
Chemical Structure Depiction of
6-(2H-1,3-benzodioxol-5-yl)-8-ethoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one
6-(2H-1,3-benzodioxol-5-yl)-8-ethoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one
Compound characteristics
| Compound ID: | 3998-0006 |
| Compound Name: | 6-(2H-1,3-benzodioxol-5-yl)-8-ethoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C20 H18 O5 |
| Smiles: | CCOC1=CC(=CC(c2c1c(C)oc2C)=O)c1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 4.1374 |
| logD: | 4.1374 |
| logSw: | -4.4104 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.376 |
| InChI Key: | LYIUCQVJIILKHM-UHFFFAOYSA-N |