methyl 5-(acetyloxy)-6-bromo-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 5-(acetyloxy)-6-bromo-2-methyl-1-benzofuran-3-carboxylate
methyl 5-(acetyloxy)-6-bromo-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 3570-0624 |
| Compound Name: | methyl 5-(acetyloxy)-6-bromo-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 327.13 |
| Molecular Formula: | C13 H11 Br O5 |
| Smiles: | CC(=O)Oc1cc2c(C(=O)OC)c(C)oc2cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.8414 |
| logD: | 2.8414 |
| logSw: | -3.0569 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.197 |
| InChI Key: | AICUSTQQPZCXJA-UHFFFAOYSA-N |