propyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
propyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
propyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 4593-1533 |
| Compound Name: | propyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 416.86 |
| Molecular Formula: | C22 H21 Cl O6 |
| Smiles: | CCCOC(COc1ccc2C(C(=COc2c1)Oc1cc(C)c(c(C)c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8497 |
| logD: | 4.8497 |
| logSw: | -5.042 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.522 |
| InChI Key: | ZRZOBQKFPYNYNK-UHFFFAOYSA-N |