2-methylpropyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
2-methylpropyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
2-methylpropyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 4593-1569 |
| Compound Name: | 2-methylpropyl {[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 430.88 |
| Molecular Formula: | C23 H23 Cl O6 |
| Smiles: | CC(C)COC(COc1ccc2C(C(=COc2c1)Oc1cc(C)c(c(C)c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3676 |
| logD: | 5.3676 |
| logSw: | -5.9279 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.603 |
| InChI Key: | JQWGMNCQXZPRSP-UHFFFAOYSA-N |