3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-2-methyl-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-2-methyl-4H-1-benzopyran-4-one
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-2-methyl-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | Y041-0493 |
| Compound Name: | 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-2-methyl-4H-1-benzopyran-4-one |
| Molecular Weight: | 310.3 |
| Molecular Formula: | C18 H14 O5 |
| Smiles: | CC1=C(C(c2ccc(cc2O1)O)=O)c1ccc2c(c1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.117 |
| logD: | 1.538 |
| logSw: | -2.8355 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.766 |
| InChI Key: | SHLNEMDFBUCZMY-UHFFFAOYSA-N |