2-[(4-bromophenyl)methylidene]-6-[(3-methylbut-2-en-1-yl)oxy]-1-benzofuran-3(2H)-one
Chemical Structure Depiction of
2-[(4-bromophenyl)methylidene]-6-[(3-methylbut-2-en-1-yl)oxy]-1-benzofuran-3(2H)-one
2-[(4-bromophenyl)methylidene]-6-[(3-methylbut-2-en-1-yl)oxy]-1-benzofuran-3(2H)-one
Compound characteristics
| Compound ID: | Y041-2504 |
| Compound Name: | 2-[(4-bromophenyl)methylidene]-6-[(3-methylbut-2-en-1-yl)oxy]-1-benzofuran-3(2H)-one |
| Molecular Weight: | 385.26 |
| Molecular Formula: | C20 H17 Br O3 |
| Smiles: | CC(C)=CCOc1ccc2C(/C(=C/c3ccc(cc3)[Br])Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9614 |
| logD: | 5.9614 |
| logSw: | -5.6449 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.7808 |
| InChI Key: | KLAIBYADEJHNMQ-UHFFFAOYSA-N |