propan-2-yl 5-[(4-bromobenzoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 5-[(4-bromobenzoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate
propan-2-yl 5-[(4-bromobenzoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 2516-2050 |
| Compound Name: | propan-2-yl 5-[(4-bromobenzoyl)oxy]-2-methyl-1-benzofuran-3-carboxylate |
| Molecular Weight: | 417.25 |
| Molecular Formula: | C20 H17 Br O5 |
| Smiles: | CC(C)OC(c1c2cc(ccc2oc1C)OC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4086 |
| logD: | 5.4086 |
| logSw: | -5.701 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.996 |
| InChI Key: | KDFWOTABNHGOQZ-UHFFFAOYSA-N |