6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl cyclohexanecarboxylate
Chemical Structure Depiction of
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl cyclohexanecarboxylate
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl cyclohexanecarboxylate
Compound characteristics
| Compound ID: | Y040-7171 |
| Compound Name: | 6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl cyclohexanecarboxylate |
| Molecular Weight: | 382.84 |
| Molecular Formula: | C22 H19 Cl O4 |
| Smiles: | C1CCC(CC1)C(=O)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2029 |
| logD: | 5.2029 |
| logSw: | -5.6906 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.031 |
| InChI Key: | NYSYYGNNPNJDSB-UHFFFAOYSA-N |