3-[3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-hydroxy-6-methyl-2H-pyran-2-one
Chemical Structure Depiction of
3-[3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-hydroxy-6-methyl-2H-pyran-2-one
3-[3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-hydroxy-6-methyl-2H-pyran-2-one
Compound characteristics
| Compound ID: | 8020-1342 |
| Compound Name: | 3-[3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-hydroxy-6-methyl-2H-pyran-2-one |
| Molecular Weight: | 360.32 |
| Molecular Formula: | C18 H16 O8 |
| Smiles: | CC1=CC(=C(C(/C=C/c2cc(c3c(c2OC)OCO3)OC)=O)C(=O)O1)O |
| Stereo: | ACHIRAL |
| logP: | 1.7231 |
| logD: | -3.6334 |
| logSw: | -1.7996 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.949 |
| InChI Key: | JZIHHRCZXGTQHG-UHFFFAOYSA-N |