TL;DR: 4-Methoxyphenylmagnesium bromide (CAS 13139-86-1) is a chemical compound with molecular formula C7H7BrMgO and molecular weight 209.95306 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
magnesium;methoxybenzene;bromide
Also Known As: 4-methoxyphenylmagnesium bromide, 4-Anisylmagnesium bromide, p-anisylmagnesium bromide, magnesium;methoxybenzene;bromide, Magnesium, bromo(4-methoxyphenyl)-
| Molecular Formula | C7H7BrMgO |
| Molecular Weight | 209.95306 g/mol |
| XLogP | -1.88141 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.95306 Da |
| Heavy Atoms | 10 |
| Complexity | 145.0 |
| SMILES | COC1=CC=[C-]C=C1.[Mg+2].[Br-] |
| InChIKey | RBWRWAUAVRMBAC-UHFFFAOYSA-M |
The XLogP value of -1.88141 indicates that 4-Methoxyphenylmagnesium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.2 Ų, 4-Methoxyphenylmagnesium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxyphenylmagnesium bromide 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 4-Methoxyphenylmagnesium bromide is 13139-86-1.
The molecular formula of 4-Methoxyphenylmagnesium bromide is C7H7BrMgO.
The molecular weight of 4-Methoxyphenylmagnesium bromide is 209.95306 g/mol.
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