2,6-bis[(3-bromo-4-fluorophenyl)methylidene]-4-(2-methylbutan-2-yl)cyclohexan-1-one
Chemical Structure Depiction of
2,6-bis[(3-bromo-4-fluorophenyl)methylidene]-4-(2-methylbutan-2-yl)cyclohexan-1-one
2,6-bis[(3-bromo-4-fluorophenyl)methylidene]-4-(2-methylbutan-2-yl)cyclohexan-1-one
Compound characteristics
| Compound ID: | C151-0729 |
| Compound Name: | 2,6-bis[(3-bromo-4-fluorophenyl)methylidene]-4-(2-methylbutan-2-yl)cyclohexan-1-one |
| Molecular Weight: | 538.27 |
| Molecular Formula: | C25 H24 Br2 F2 O |
| Smiles: | CCC(C)(C)C1C/C(=C\c2ccc(c(c2)[Br])F)C(C(\C1)=C\c1ccc(c(c1)[Br])F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7668 |
| logD: | 7.7668 |
| logSw: | -5.6432 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 13.0339 |
| InChI Key: | KJZVJWWSXNNDGE-UHFFFAOYSA-N |