4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl (3-chlorophenoxy)acetate
Chemical Structure Depiction of
4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl (3-chlorophenoxy)acetate
4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl (3-chlorophenoxy)acetate
Compound characteristics
| Compound ID: | 2712-4089 |
| Compound Name: | 4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl (3-chlorophenoxy)acetate |
| Molecular Weight: | 370.79 |
| Molecular Formula: | C20 H15 Cl O5 |
| Smiles: | C1CC2=C(C1)c1ccc(cc1OC2=O)OC(COc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9566 |
| logD: | 3.9566 |
| logSw: | -4.3813 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.729 |
| InChI Key: | YAMKJIYNNCLLFY-UHFFFAOYSA-N |