TL;DR: Magnesium bromide 3,4,5-trifluorobenzen-1-ide (1/1/1) (CAS 156006-28-9) is a chemical compound with molecular formula C6H2BrF3Mg and molecular weight 233.91425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
magnesium;1,2,3-trifluorobenzene-5-ide;bromide
Also Known As: 3,4,5-Trifluorophenylmagnesium bromide, bromo(3,4,5-trifluorophenyl)magnesium, Magnesium,bromo(3,4,5-trifluorophenyl)-, Magnesium, bromo(3,4,5-trifluorophenyl)-, 3,4,5-trifluorophenyl magnesium bromide
| Molecular Formula | C6H2BrF3Mg |
| Molecular Weight | 233.91425 g/mol |
| XLogP | -1.47271 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 233.91425 Da |
| Heavy Atoms | 11 |
| Complexity | 198.0 |
| SMILES | C1=[C-]C=C(C(=C1F)F)F.[Mg+2].[Br-] |
| InChIKey | FAANOBAJWDSCGM-UHFFFAOYSA-M |
The XLogP value of -1.47271 indicates that Magnesium bromide 3,4,5-trifluorobenzen-1-ide (1/1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, Magnesium bromide 3,4,5-trifluorobenzen-1-ide (1/1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Magnesium bromide 3,4,5-trifluorobenzen-1-ide (1/1/1) has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Magnesium bromide 3,4,5-trifluorobenzen-1-ide (1/1/1) is 156006-28-9.
The molecular formula of Magnesium bromide 3,4,5-trifluorobenzen-1-ide (1/1/1) is C6H2BrF3Mg.
The molecular weight of Magnesium bromide 3,4,5-trifluorobenzen-1-ide (1/1/1) is 233.91425 g/mol.
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