4-chlorophenyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
4-chlorophenyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
4-chlorophenyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8007-7756 |
| Compound Name: | 4-chlorophenyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C16 H7 Br2 Cl O4 |
| Smiles: | C1=C(C(=O)Oc2ccc(cc2)[Cl])C(=O)Oc2c1cc(cc2[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.4463 |
| logD: | 5.4463 |
| logSw: | -6.1198 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.222 |
| InChI Key: | YMBARVGDJHOIKV-UHFFFAOYSA-N |