3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl butanoate
Chemical Structure Depiction of
3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl butanoate
3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl butanoate
Compound characteristics
| Compound ID: | 3130-1386 |
| Compound Name: | 3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl butanoate |
| Molecular Weight: | 403.23 |
| Molecular Formula: | C19 H15 Br O5 |
| Smiles: | CCCC(=O)Oc1ccc2C(C(=COc2c1)Oc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4564 |
| logD: | 4.4564 |
| logSw: | -4.5328 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.711 |
| InChI Key: | ZQGOWTYJSUUCAZ-UHFFFAOYSA-N |