3-ethyl-4,8-dimethyl-7-[(3-oxobutan-2-yl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-ethyl-4,8-dimethyl-7-[(3-oxobutan-2-yl)oxy]-2H-1-benzopyran-2-one
3-ethyl-4,8-dimethyl-7-[(3-oxobutan-2-yl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0612 |
| Compound Name: | 3-ethyl-4,8-dimethyl-7-[(3-oxobutan-2-yl)oxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 288.34 |
| Molecular Formula: | C17 H20 O4 |
| Smiles: | CCC1=C(C)c2ccc(c(C)c2OC1=O)OC(C)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6881 |
| logD: | 3.6881 |
| logSw: | -3.9301 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.547 |
| InChI Key: | WOMINHDQHXJRFR-LBPRGKRZSA-N |