2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl
TL;DR: 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl (CAS 66640-68-4) is a chemical compound with molecular formula C14H10Cl4O4S2 and molecular weight 445.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dichloro-2-(2,5-dichloro-4-methylsulfonylphenyl)-5-methylsulfonylbenzene
Also Known As: Bmstbp, 1utr, 4,4'-Bis(methylsulfonyl)-2,2',5,5'-tetrachlorobiphenyl, 2,2',5,5'-tetrachloro-4,4'-bis(methylsulfonyl)biphenyl, 4,4'-BIS([H]METHYLSULFONYL)-2,2',5,5'-TETRACHLOROBIPHENYL
| Molecular Formula | C14H10Cl4O4S2 |
|---|---|
| Molecular Weight | 445.88 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 447.8745 |
| Heavy Atoms | 24 |
| Complexity | 597.0 |
Chemical Identifiers
| CAS Number | 66640-68-4 |
|---|---|
| SMILES | CS(=O)(=O)C1=C(C=C(C(=C1)Cl)C2=CC(=C(C=C2Cl)S(=O)(=O)C)Cl)Cl |
| InChIKey | RDBKPLOYRMCFIY-UHFFFAOYSA-N |
Product Overview
2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl (CAS 66640-68-4), with molecular formula C14H10Cl4O4S2 and molecular weight 445.88 g/mol. IUPAC: 1,4-dichloro-2-(2,5-dichloro-4-methylsulfonylphenyl)-5-methylsulfonylbenzene.
Chemical Property Profile of 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl
Property Insights of 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl
The XLogP value of 4.4 indicates that 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl. Following Lipinski's Rule of Five, 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl?
The CAS number of 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl is 66640-68-4.
What is the molecular formula of 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl?
The molecular formula of 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl is C14H10Cl4O4S2.
What is the molecular weight of 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl?
The molecular weight of 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl is 445.88 g/mol.
Where can I buy 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl?
You can request a quote for 2,2',5,5'-Tetrachloro-4,4'-bis(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',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2,2',5,5'-Tetrachloro-4,4'-bis(methylsulfonyl)-1,1'-biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.