methyl (7-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)acetate
Chemical Structure Depiction of
methyl (7-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)acetate
methyl (7-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)acetate
Compound characteristics
| Compound ID: | Y043-7923 |
| Compound Name: | methyl (7-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)acetate |
| Molecular Weight: | 248.23 |
| Molecular Formula: | C13 H12 O5 |
| Smiles: | Cc1c(ccc2C(CC(=O)OC)=CC(=O)Oc12)O |
| Stereo: | ACHIRAL |
| logP: | 1.5216 |
| logD: | 1.5171 |
| logSw: | -2.2137 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.457 |
| InChI Key: | WMUYFTOUXUEMBV-UHFFFAOYSA-N |