TL;DR: 2'-Bromo-4,4''-dimethyl-(1,1',3',1'')terphenyl (CAS 154488-08-1) is a chemical compound with molecular formula C20H17Br and molecular weight 336.05136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-1,3-bis(4-methylphenyl)benzene
Also Known As: 2,6-Bis(4-methylphenyl)phenyl bromide, 2-bromo-1,3-bis(4-methylphenyl)benzene, J1.985.608I, 2'-BROMO-4,4''-DIMETHYL-(1,1',3',1'')TERPHENYL, 2-bromo-4'-methyl-3-(4-methylphenyl)-1,1'-biphenyl
| Molecular Formula | C20H17Br |
| Molecular Weight | 336.05136 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.05136 Da |
| Heavy Atoms | 21 |
| Complexity | 280.0 |
| SMILES | CC1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=C(C=C3)C)Br |
| InChIKey | SDZVPBQRSUWAJJ-UHFFFAOYSA-N |
The XLogP value of 6.6 indicates that 2'-Bromo-4,4''-dimethyl-(1,1',3',1'')terphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2'-Bromo-4,4''-dimethyl-(1,1',3',1'')terphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-Bromo-4,4''-dimethyl-(1,1',3',1'')terphenyl has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2'-Bromo-4,4''-dimethyl-(1,1',3',1'')terphenyl is 154488-08-1.
The molecular formula of 2'-Bromo-4,4''-dimethyl-(1,1',3',1'')terphenyl is C20H17Br.
The molecular weight of 2'-Bromo-4,4''-dimethyl-(1,1',3',1'')terphenyl is 336.05136 g/mol.
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