ethyl 4-bromo-5-[(2-chloro-4-nitrobenzoyl)oxy]-2-formyl-7-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
ethyl 4-bromo-5-[(2-chloro-4-nitrobenzoyl)oxy]-2-formyl-7-methyl-1-benzofuran-3-carboxylate
ethyl 4-bromo-5-[(2-chloro-4-nitrobenzoyl)oxy]-2-formyl-7-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 1486-0350 |
| Compound Name: | ethyl 4-bromo-5-[(2-chloro-4-nitrobenzoyl)oxy]-2-formyl-7-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 510.68 |
| Molecular Formula: | C20 H13 Br Cl N O8 |
| Smiles: | CCOC(c1c2c(c(cc(C)c2oc1C=O)OC(c1ccc(cc1[Cl])[N+]([O-])=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1758 |
| logD: | 5.1758 |
| logSw: | -5.7718 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 96.927 |
| InChI Key: | XZFWHZCBSWFQNI-UHFFFAOYSA-N |