10-(4-bromophenyl)-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one
Chemical Structure Depiction of
10-(4-bromophenyl)-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one
10-(4-bromophenyl)-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one
Compound characteristics
| Compound ID: | D143-0452 |
| Compound Name: | 10-(4-bromophenyl)-1,2,3,4-tetrahydro-5H-6,8-dioxacyclopenta[b]phenanthren-5-one |
| Molecular Weight: | 395.25 |
| Molecular Formula: | C21 H15 Br O3 |
| Smiles: | C1CCC2=C(C1)C(=O)Oc1cc3c(cc12)c(co3)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.1461 |
| logD: | 6.1461 |
| logSw: | -6.1446 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.3688 |
| InChI Key: | QKOQDIWTUMYITQ-UHFFFAOYSA-N |