methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-4-oxobut-2-enoate
Chemical Structure Depiction of
methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-4-oxobut-2-enoate
methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-4-oxobut-2-enoate
Compound characteristics
| Compound ID: | 8020-0088 |
| Compound Name: | methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-4-oxobut-2-enoate |
| Molecular Weight: | 264.23 |
| Molecular Formula: | C13 H12 O6 |
| Smiles: | COC(/C(=C/C(c1ccc2c(c1)OCCO2)=O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.545 |
| logD: | 0.1588 |
| logSw: | -1.5658 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.044 |
| InChI Key: | KRWDIHPBACQHRQ-UHFFFAOYSA-N |