benzyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
benzyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
benzyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 1636-0076 |
| Compound Name: | benzyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 438.07 |
| Molecular Formula: | C17 H10 Br2 O4 |
| Smiles: | C(c1ccccc1)OC(C1=Cc2cc(cc(c2OC1=O)[Br])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9382 |
| logD: | 4.9382 |
| logSw: | -5.1969 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.702 |
| InChI Key: | UXIMRLNBBYKVSJ-UHFFFAOYSA-N |