4-acetylphenyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
4-acetylphenyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
4-acetylphenyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 3772-6673 |
| Compound Name: | 4-acetylphenyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 387.18 |
| Molecular Formula: | C18 H11 Br O5 |
| Smiles: | CC(c1ccc(cc1)OC(C1=Cc2cc(ccc2OC1=O)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4016 |
| logD: | 3.4016 |
| logSw: | -3.5928 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.365 |
| InChI Key: | URJSJFNKBJZFTE-UHFFFAOYSA-N |