TL;DR: 1-(5-Bromo-7-Methoxy-1-Benzofuran-2-Yl)Ethan-1-One (CAS 150612-66-1) is a chemical compound with molecular formula C11H9BrO3 and molecular weight 267.9735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-bromo-7-methoxy-1-benzofuran-2-yl)ethanone
Also Known As: 1-(5-Bromo-7-Methoxy-1-Benzofuran-2-Yl)Ethan-1-One, 1-(5-Bromo-7-methoxybenzofuran-2-yl)ethanone, 1-(5-bromo-7-methoxy-1-benzofuran-2-yl)ethanone, 2-acetyl-5-bromo-7-methoxybenzofuran, 1-(5-bromo-7-methoxy-1-benzofuran-2-yl)-1-ethanone
| Molecular Formula | C11H9BrO3 |
| Molecular Weight | 267.9735 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.9735 Da |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
| SMILES | CC(=O)C1=CC2=CC(=CC(=C2O1)OC)Br |
| InChIKey | FQQBNIWOOXIDEP-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 1-(5-Bromo-7-Methoxy-1-Benzofuran-2-Yl)Ethan-1-One is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, 1-(5-Bromo-7-Methoxy-1-Benzofuran-2-Yl)Ethan-1-One exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Bromo-7-Methoxy-1-Benzofuran-2-Yl)Ethan-1-One has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(5-Bromo-7-Methoxy-1-Benzofuran-2-Yl)Ethan-1-One is 150612-66-1.
The molecular formula of 1-(5-Bromo-7-Methoxy-1-Benzofuran-2-Yl)Ethan-1-One is C11H9BrO3.
The molecular weight of 1-(5-Bromo-7-Methoxy-1-Benzofuran-2-Yl)Ethan-1-One is 267.9735 g/mol.
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