TL;DR: 1,1'-Biphenyl, 3,3',4-trichloro-4'-methoxy- (CAS 124882-73-1) is a chemical compound with molecular formula C13H9Cl3O and molecular weight 285.9719 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-dichloro-4-(3-chloro-4-methoxyphenyl)benzene
Also Known As: 1,1'-Biphenyl, 3,3',4-trichloro-4'-methoxy-, 3,3',4'-trichloro-4-methoxybiphenyl, 1,2-dichloro-4-(3-chloro-4-methoxyphenyl)benzene, 3,3',4-trichloro-4'-methoxy-1,1'-biphenyl, 3,3 ,4 -Trichloro-4-methoxybiphenyl
| Molecular Formula | C13H9Cl3O |
| Molecular Weight | 285.9719 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.9719 Da |
| Heavy Atoms | 17 |
| Complexity | 249.0 |
| SMILES | COC1=C(C=C(C=C1)C2=CC(=C(C=C2)Cl)Cl)Cl |
| InChIKey | HEPYVKVRVSITAU-UHFFFAOYSA-N |
The XLogP value of 6.0 indicates that 1,1'-Biphenyl, 3,3',4-trichloro-4'-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1,1'-Biphenyl, 3,3',4-trichloro-4'-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Biphenyl, 3,3',4-trichloro-4'-methoxy- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,1'-Biphenyl, 3,3',4-trichloro-4'-methoxy- is 124882-73-1.
The molecular formula of 1,1'-Biphenyl, 3,3',4-trichloro-4'-methoxy- is C13H9Cl3O.
The molecular weight of 1,1'-Biphenyl, 3,3',4-trichloro-4'-methoxy- is 285.9719 g/mol.
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