2-methylpropyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
Chemical Structure Depiction of
2-methylpropyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
2-methylpropyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
Compound characteristics
| Compound ID: | 4593-1612 |
| Compound Name: | 2-methylpropyl 2-{[3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate |
| Molecular Weight: | 444.91 |
| Molecular Formula: | C24 H25 Cl O6 |
| Smiles: | CC(C)COC(C(C)Oc1ccc2C(C(=COc2c1)Oc1cc(C)c(c(C)c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8693 |
| logD: | 5.8693 |
| logSw: | -6.1691 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.488 |
| InChI Key: | YPILLHZYTDZBQN-INIZCTEOSA-N |