ethyl 3-(2H-1,3-benzodioxol-5-yl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
Chemical Structure Depiction of
ethyl 3-(2H-1,3-benzodioxol-5-yl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
ethyl 3-(2H-1,3-benzodioxol-5-yl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
Compound characteristics
| Compound ID: | 8020-7350 |
| Compound Name: | ethyl 3-(2H-1,3-benzodioxol-5-yl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate |
| Molecular Weight: | 362.33 |
| Molecular Formula: | C18 H18 O8 |
| Smiles: | CCOC(CC(C1=C(C(C=C(CO)O1)=O)O)c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4856 |
| logD: | 1.395 |
| logSw: | -2.0322 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.839 |
| InChI Key: | DZZAKSJWLCMAGJ-LBPRGKRZSA-N |