2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl
TL;DR: 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl (CAS 104086-06-8) is a chemical compound with molecular formula C13H8Cl4O2S and molecular weight 367.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4-trichloro-5-(4-chloro-2-methylsulfonylphenyl)benzene
Also Known As: 2-Biphenylyl-methylsulfon, 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl, 1,1'-Biphenyl, 2,4,4',5-tetrachloro-2'-(methylsulfonyl)-, 1,1'-Biphenyl,2,4,4',5-tetrachloro-2'-(methylsulfonyl)-, 1,2,4-trichloro-5-(4-chloro-2-methylsulfonylphenyl)benzene
| Molecular Formula | C13H8Cl4O2S |
|---|---|
| Molecular Weight | 367.90 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 367.8999 |
| Heavy Atoms | 20 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 104086-06-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=C(C=CC(=C1)Cl)C2=CC(=C(C=C2Cl)Cl)Cl |
| InChIKey | SYTCEDOCJUIGCP-UHFFFAOYSA-N |
Product Overview
2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl (CAS 104086-06-8), with molecular formula C13H8Cl4O2S and molecular weight 367.90 g/mol. IUPAC: 1,2,4-trichloro-5-(4-chloro-2-methylsulfonylphenyl)benzene.
Chemical Property Profile of 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl
Property Insights of 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl
The XLogP value of 5.8 indicates that 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl?
The CAS number of 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl is 104086-06-8.
What is the molecular formula of 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl?
The molecular formula of 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl is C13H8Cl4O2S.
What is the molecular weight of 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl?
The molecular weight of 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl is 367.90 g/mol.
Where can I buy 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl?
You can request a quote for 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2,4,4',5-Tetrachloro-2'-(methylsulfonyl)-1,1'-biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.