7-[2-(4-bromophenyl)-2-oxoethoxy]-8-chloro-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
7-[2-(4-bromophenyl)-2-oxoethoxy]-8-chloro-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
7-[2-(4-bromophenyl)-2-oxoethoxy]-8-chloro-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-1274 |
| Compound Name: | 7-[2-(4-bromophenyl)-2-oxoethoxy]-8-chloro-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 433.68 |
| Molecular Formula: | C20 H14 Br Cl O4 |
| Smiles: | C1CC2=C(C1)c1cc(c(cc1OC2=O)OCC(c1ccc(cc1)[Br])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1268 |
| logD: | 5.1268 |
| logSw: | -5.5817 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.008 |
| InChI Key: | PJCKKRMOKFVVJH-UHFFFAOYSA-N |