7'-[(3-oxobutan-2-yl)oxy]-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
Chemical Structure Depiction of
7'-[(3-oxobutan-2-yl)oxy]-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
7'-[(3-oxobutan-2-yl)oxy]-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione
Compound characteristics
| Compound ID: | Y040-4455 |
| Compound Name: | 7'-[(3-oxobutan-2-yl)oxy]-2H,2'H-[3,4'-bi-1-benzopyran]-2,2'-dione |
| Molecular Weight: | 376.36 |
| Molecular Formula: | C22 H16 O6 |
| Smiles: | CC(C(C)=O)Oc1ccc2C(=CC(=O)Oc2c1)C1=Cc2ccccc2OC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8693 |
| logD: | 2.8693 |
| logSw: | -3.3964 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.912 |
| InChI Key: | BZHBGIPKYGEXDD-ZDUSSCGKSA-N |