ethyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
Chemical Structure Depiction of
ethyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
ethyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate
Compound characteristics
| Compound ID: | 4593-1572 |
| Compound Name: | ethyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}butanoate |
| Molecular Weight: | 430.88 |
| Molecular Formula: | C23 H23 Cl O6 |
| Smiles: | CCC(C(=O)OCC)Oc1ccc2C(C(=COc2c1)Oc1cc(C)c(c(C)c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6431 |
| logD: | 5.6431 |
| logSw: | -5.9966 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.996 |
| InChI Key: | QLJAJEGLWNTWDS-SFHVURJKSA-N |