methyl 6-bromo-5-(2-tert-butoxy-2-oxoethoxy)-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 6-bromo-5-(2-tert-butoxy-2-oxoethoxy)-2-methyl-1-benzofuran-3-carboxylate
methyl 6-bromo-5-(2-tert-butoxy-2-oxoethoxy)-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 3570-0698 |
| Compound Name: | methyl 6-bromo-5-(2-tert-butoxy-2-oxoethoxy)-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 399.24 |
| Molecular Formula: | C17 H19 Br O6 |
| Smiles: | Cc1c(C(=O)OC)c2cc(c(cc2o1)[Br])OCC(=O)OC(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.0089 |
| logD: | 4.0089 |
| logSw: | -4.387 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.214 |
| InChI Key: | WGARMWFYPQZGSS-UHFFFAOYSA-N |