8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl acetate
Chemical Structure Depiction of
8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl acetate
8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl acetate
Compound characteristics
| Compound ID: | Y040-1271 |
| Compound Name: | 8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl acetate |
| Molecular Weight: | 278.69 |
| Molecular Formula: | C14 H11 Cl O4 |
| Smiles: | CC(=O)Oc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.7229 |
| logD: | 2.7229 |
| logSw: | -3.3932 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.284 |
| InChI Key: | HYFFAJVZLXGFRB-UHFFFAOYSA-N |