2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl
TL;DR: 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl (CAS 104086-01-3) 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.
1,5-dichloro-2-(2,5-dichlorophenyl)-4-methylsulfonylbenzene
Also Known As: 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl, 1,1'-Biphenyl, 2,2',4,5'-tetrachloro-5-(methylsulfonyl)-, 2,2',4,5'-Tetrachloro-5-(methanesulfonyl)-1,1'-biphenyl, 1,5-dichloro-2-(2,5-dichlorophenyl)-4-methylsulfonylbenzene
| Molecular Formula | C13H8Cl4O2S |
|---|---|
| Molecular Weight | 367.90 g/mol |
| LogP | 5.1 |
| 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 | 104086-01-3 |
|---|---|
| SMILES | CS(=O)(=O)C1=C(C=C(C(=C1)C2=C(C=CC(=C2)Cl)Cl)Cl)Cl |
| InChIKey | WPBXJSHXLVMETJ-UHFFFAOYSA-N |
Product Overview
2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl (CAS 104086-01-3), with molecular formula C13H8Cl4O2S and molecular weight 367.90 g/mol. IUPAC: 1,5-dichloro-2-(2,5-dichlorophenyl)-4-methylsulfonylbenzene.
Chemical Property Profile of 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl
Property Insights of 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl
The XLogP value of 5.1 indicates that 2,2',4,5'-Tetrachloro-5-(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, 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',4,5'-Tetrachloro-5-(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 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl?
The CAS number of 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl is 104086-01-3.
What is the molecular formula of 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl?
The molecular formula of 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl is C13H8Cl4O2S.
What is the molecular weight of 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl?
The molecular weight of 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl is 367.90 g/mol.
Where can I buy 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl?
You can request a quote for 2,2',4,5'-Tetrachloro-5-(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 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2,2',4,5'-Tetrachloro-5-(methylsulfonyl)-1,1-biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.