methyl 6-bromo-5-[(4-chlorobenzoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 6-bromo-5-[(4-chlorobenzoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate
methyl 6-bromo-5-[(4-chlorobenzoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 3570-0657 |
| Compound Name: | methyl 6-bromo-5-[(4-chlorobenzoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 423.65 |
| Molecular Formula: | C18 H12 Br Cl O5 |
| Smiles: | Cc1c(C(=O)OC)c2cc(c(cc2o1)[Br])OC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.985 |
| logD: | 4.985 |
| logSw: | -5.5494 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.824 |
| InChI Key: | ROGCUTFMTNDQNY-UHFFFAOYSA-N |