8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 4-methoxybenzoate
Chemical Structure Depiction of
8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 4-methoxybenzoate
8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 4-methoxybenzoate
Compound characteristics
| Compound ID: | Y040-1268 |
| Compound Name: | 8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 4-methoxybenzoate |
| Molecular Weight: | 370.79 |
| Molecular Formula: | C20 H15 Cl O5 |
| Smiles: | COc1ccc(cc1)C(=O)Oc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 4.2541 |
| logD: | 4.2541 |
| logSw: | -4.6348 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.455 |
| InChI Key: | QKUIZRFMIBADCW-UHFFFAOYSA-N |