2-(4-bromophenyl)-2-oxoethyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
2-(4-bromophenyl)-2-oxoethyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
2-(4-bromophenyl)-2-oxoethyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 0848-0159 |
| Compound Name: | 2-(4-bromophenyl)-2-oxoethyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 466.08 |
| Molecular Formula: | C18 H10 Br2 O5 |
| Smiles: | C(C(c1ccc(cc1)[Br])=O)OC(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1935 |
| logD: | 4.1935 |
| logSw: | -4.6093 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.265 |
| InChI Key: | XSEVUWOHVKEEHC-UHFFFAOYSA-N |