8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl cyclohexanecarboxylate
Chemical Structure Depiction of
8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl cyclohexanecarboxylate
8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl cyclohexanecarboxylate
Compound characteristics
| Compound ID: | 4358-7334 |
| Compound Name: | 8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl cyclohexanecarboxylate |
| Molecular Weight: | 346.81 |
| Molecular Formula: | C19 H19 Cl O4 |
| Smiles: | C1CCC(CC1)C(=O)Oc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 4.5887 |
| logD: | 4.5887 |
| logSw: | -4.8168 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.103 |
| InChI Key: | HIAGOKVAQZKPKN-UHFFFAOYSA-N |