3-(2-chlorophenoxy)-4-oxo-4H-1-benzopyran-7-yl cyclohexanecarboxylate
Chemical Structure Depiction of
3-(2-chlorophenoxy)-4-oxo-4H-1-benzopyran-7-yl cyclohexanecarboxylate
3-(2-chlorophenoxy)-4-oxo-4H-1-benzopyran-7-yl cyclohexanecarboxylate
Compound characteristics
| Compound ID: | 4593-1475 |
| Compound Name: | 3-(2-chlorophenoxy)-4-oxo-4H-1-benzopyran-7-yl cyclohexanecarboxylate |
| Molecular Weight: | 398.84 |
| Molecular Formula: | C22 H19 Cl O5 |
| Smiles: | C1CCC(CC1)C(=O)Oc1ccc2C(C(=COc2c1)Oc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.229 |
| logD: | 5.229 |
| logSw: | -5.6487 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.227 |
| InChI Key: | WVMWOZJHRJWHGL-UHFFFAOYSA-N |