methyl (7,8-dihydroxy-2-oxo-2H-1-benzopyran-4-yl)acetate
Chemical Structure Depiction of
methyl (7,8-dihydroxy-2-oxo-2H-1-benzopyran-4-yl)acetate
methyl (7,8-dihydroxy-2-oxo-2H-1-benzopyran-4-yl)acetate
Compound characteristics
| Compound ID: | D715-1095 |
| Compound Name: | methyl (7,8-dihydroxy-2-oxo-2H-1-benzopyran-4-yl)acetate |
| Molecular Weight: | 250.2 |
| Molecular Formula: | C12 H10 O6 |
| Smiles: | COC(CC1=CC(=O)Oc2c1ccc(c2O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0146 |
| logD: | 0.9528 |
| logSw: | -2.2507 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.936 |
| InChI Key: | FCQBXNDMJFTONS-UHFFFAOYSA-N |