3-(2-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 3-bromobenzoate
Chemical Structure Depiction of
3-(2-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 3-bromobenzoate
3-(2-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 3-bromobenzoate
Compound characteristics
| Compound ID: | 5596-0457 |
| Compound Name: | 3-(2-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 3-bromobenzoate |
| Molecular Weight: | 455.69 |
| Molecular Formula: | C22 H12 Br Cl O4 |
| Smiles: | C1=C(C(c2ccc(cc2O1)OC(c1cccc(c1)[Br])=O)=O)c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3501 |
| logD: | 5.3501 |
| logSw: | -5.9216 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.238 |
| InChI Key: | XZONSLPJOANYKH-UHFFFAOYSA-N |