2-methylpropyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
Chemical Structure Depiction of
2-methylpropyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
2-methylpropyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate
Compound characteristics
| Compound ID: | 4593-1536 |
| Compound Name: | 2-methylpropyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}propanoate |
| Molecular Weight: | 416.86 |
| Molecular Formula: | C22 H21 Cl O6 |
| Smiles: | CC(C)COC(C(C)Oc1ccc2C(C(=COc2c1)Oc1ccccc1[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.854 |
| logD: | 4.854 |
| logSw: | -4.8954 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.575 |
| InChI Key: | AIBQYNGRTFEVDQ-AWEZNQCLSA-N |