4-methoxyphenyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
4-methoxyphenyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
4-methoxyphenyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 1605-0080 |
| Compound Name: | 4-methoxyphenyl 6,8-dibromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 454.07 |
| Molecular Formula: | C17 H10 Br2 O5 |
| Smiles: | COc1ccc(cc1)OC(C1=Cc2cc(cc(c2OC1=O)[Br])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.834 |
| logD: | 4.834 |
| logSw: | -4.8397 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.766 |
| InChI Key: | YPPDFLBXFHKMDL-UHFFFAOYSA-N |