4,7-dimethyl-5-[(3-oxobutan-2-yl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4,7-dimethyl-5-[(3-oxobutan-2-yl)oxy]-2H-1-benzopyran-2-one
4,7-dimethyl-5-[(3-oxobutan-2-yl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0278 |
| Compound Name: | 4,7-dimethyl-5-[(3-oxobutan-2-yl)oxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 260.29 |
| Molecular Formula: | C15 H16 O4 |
| Smiles: | CC(C(C)=O)Oc1cc(C)cc2c1C(C)=CC(=O)O2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9081 |
| logD: | 2.9081 |
| logSw: | -3.0064 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.348 |
| InChI Key: | PFJRWPCYEGNBDR-NSHDSACASA-N |