2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene
TL;DR: 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene (CAS 104085-98-5) is a chemical compound with molecular formula C13H9Cl3O2S and molecular weight 333.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene
Also Known As: 2-Biphenylyl-methylsulfon, 2,5-dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene, 2,2',5-trichloro-3-(methylsulfonyl)biphenyl, 1,1'-Biphenyl,2,2',5-trichloro-3-(methylsulfonyl)-, 2,2',5-Trichloro-3-(methanesulfonyl)-1,1'-biphenyl
| Molecular Formula | C13H9Cl3O2S |
|---|---|
| Molecular Weight | 333.94 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.93887 |
| Heavy Atoms | 19 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 104085-98-5 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC(=CC(=C1Cl)C2=CC=CC=C2Cl)Cl |
| InChIKey | IVDLSNCJBWAWQQ-UHFFFAOYSA-N |
Product Overview
2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene (CAS 104085-98-5), with molecular formula C13H9Cl3O2S and molecular weight 333.94 g/mol. IUPAC: 2,5-dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene.
Chemical Property Profile of 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene
Property Insights of 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene
The XLogP value of 4.4 indicates that 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene 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 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene?
The CAS number of 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene is 104085-98-5.
What is the molecular formula of 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene?
The molecular formula of 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene is C13H9Cl3O2S.
What is the molecular weight of 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene?
The molecular weight of 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene is 333.94 g/mol.
Where can I buy 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene?
You can request a quote for 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dichloro-1-(2-chlorophenyl)-3-methylsulfonylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.