2-oxo-2-phenylethyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
2-oxo-2-phenylethyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
2-oxo-2-phenylethyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 2222-0088 |
| Compound Name: | 2-oxo-2-phenylethyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 387.18 |
| Molecular Formula: | C18 H11 Br O5 |
| Smiles: | C(C(c1ccccc1)=O)OC(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2545 |
| logD: | 3.2545 |
| logSw: | -3.5223 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.265 |
| InChI Key: | VKDAKGGGDMRZJC-UHFFFAOYSA-N |