3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-methylbenzoate
Chemical Structure Depiction of
3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-methylbenzoate
3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-methylbenzoate
Compound characteristics
| Compound ID: | 3130-1403 |
| Compound Name: | 3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl 2-methylbenzoate |
| Molecular Weight: | 451.27 |
| Molecular Formula: | C23 H15 Br O5 |
| Smiles: | Cc1ccccc1C(=O)Oc1ccc2C(C(=COc2c1)Oc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3845 |
| logD: | 5.3845 |
| logSw: | -5.5877 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.034 |
| InChI Key: | RUSOKELFUFGABA-UHFFFAOYSA-N |