TL;DR: 1-(2-Bromo-1-(4-chlorophenyl)ethyl)-4-chlorobenzene (CAS 121043-47-8) is a chemical compound with molecular formula C14H11BrCl2 and molecular weight 327.9421 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-bromo-1-(4-chlorophenyl)ethyl]-4-chlorobenzene
Also Known As: 1-(2-Bromo-1-(4-chlorophenyl)ethyl)-4-chlorobenzene, 1,1'-(2-bromoethylidene)bis[4-chloro-benzene, 1-[2-bromo-1-(4-chlorophenyl)ethyl]-4-chlorobenzene, BENZENE,1,1'-(2-BROMOETHYLIDENE)BIS[4-CHLORO-, 1,1'-(2-Bromoethane-1,1-diyl)bis(4-chlorobenzene)
| Molecular Formula | C14H11BrCl2 |
| Molecular Weight | 327.9421 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.9421 Da |
| Heavy Atoms | 17 |
| Complexity | 196.0 |
| SMILES | C1=CC(=CC=C1C(CBr)C2=CC=C(C=C2)Cl)Cl |
| InChIKey | PEHQGSYXZOLXHE-UHFFFAOYSA-N |
The XLogP value of 5.8 indicates that 1-(2-Bromo-1-(4-chlorophenyl)ethyl)-4-chlorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(2-Bromo-1-(4-chlorophenyl)ethyl)-4-chlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromo-1-(4-chlorophenyl)ethyl)-4-chlorobenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1-(2-Bromo-1-(4-chlorophenyl)ethyl)-4-chlorobenzene is 121043-47-8.
The molecular formula of 1-(2-Bromo-1-(4-chlorophenyl)ethyl)-4-chlorobenzene is C14H11BrCl2.
The molecular weight of 1-(2-Bromo-1-(4-chlorophenyl)ethyl)-4-chlorobenzene is 327.9421 g/mol.
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