1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-
TL;DR: 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- (CAS 100757-63-9) is a chemical compound with molecular formula C13H8Cl4OS and molecular weight 351.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dichloro-2-(2,5-dichlorophenyl)-5-methylsulfinylbenzene
Also Known As: 4-MeSO-CB52, J2.562.994I, 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-, 2,2 ,5,5 -Tetrachloro-4-(methylsulfinyl)biphenyl, 2,2',5,5'-tetrachloro-4-methanesulfinyl-1,1'-biphenyl
| Molecular Formula | C13H8Cl4OS |
|---|---|
| Molecular Weight | 351.90 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.905 |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 100757-63-9 |
|---|---|
| SMILES | CS(=O)C1=C(C=C(C(=C1)Cl)C2=C(C=CC(=C2)Cl)Cl)Cl |
| InChIKey | UFTXERPNOXDLCM-UHFFFAOYSA-N |
Product Overview
1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- (CAS 100757-63-9), with molecular formula C13H8Cl4OS and molecular weight 351.90 g/mol. IUPAC: 1,4-dichloro-2-(2,5-dichlorophenyl)-5-methylsulfinylbenzene.
Chemical Property Profile of 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-
Property Insights of 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-
The XLogP value of 5.0 indicates that 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.3 Ų, 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- has 0 hydrogen bond donor(s) and 2 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 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-?
The CAS number of 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- is 100757-63-9.
What is the molecular formula of 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-?
The molecular formula of 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- is C13H8Cl4OS.
What is the molecular weight of 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-?
The molecular weight of 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- is 351.90 g/mol.
Where can I buy 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-?
You can request a quote for 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Biphenyl, 2,2',5,5'-tetrachloro-4-(methylsulfinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.