TL;DR: Bis(2-bromo-4-chlorophenyl)iodanium chloride (CAS 63938-71-6) is a chemical compound with molecular formula C12H6Br2Cl3I and molecular weight 539.69464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(2-bromo-4-chlorophenyl)iodanium chloride
Also Known As: Bis(2-bromo-4-chlorophenyl)iodonium chloride, bis(2-bromo-4-chlorophenyl)iodanium chloride, IODONIUM, BIS(2-BROMO-4-CHLOROPHENYL)-, CHLORIDE
| Molecular Formula | C12H6Br2Cl3I |
| Molecular Weight | 539.69464 g/mol |
| XLogP | -0.35 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 541.6926 Da |
| Heavy Atoms | 18 |
| Complexity | 231.0 |
| SMILES | C1=CC(=C(C=C1Cl)Br)[I+]C2=C(C=C(C=C2)Cl)Br.[Cl-] |
| InChIKey | XAIKAKBCPNDVEK-UHFFFAOYSA-M |
The XLogP value of -0.35 indicates that Bis(2-bromo-4-chlorophenyl)iodanium chloride 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, Bis(2-bromo-4-chlorophenyl)iodanium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2-bromo-4-chlorophenyl)iodanium chloride has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Bis(2-bromo-4-chlorophenyl)iodanium chloride is 63938-71-6.
The molecular formula of Bis(2-bromo-4-chlorophenyl)iodanium chloride is C12H6Br2Cl3I.
The molecular weight of Bis(2-bromo-4-chlorophenyl)iodanium chloride is 539.69464 g/mol.
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