1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-
TL;DR: 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- (CAS 149949-87-1) is a chemical compound with molecular formula C13H7Cl5O2S and molecular weight 401.86093 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,4-trichloro-2-(2,4-dichlorophenyl)-5-methylsulfonylbenzene
Also Known As: 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-, 1,3,4-trichloro-2-(2,4-dichlorophenyl)-5-methylsulfonylbenzene, 2,2',3,4',6-Pentachloro-4-methylsulfonylbiphenyl, 2,2',3,4',6-Pentachloro-4-(methylsulfonyl)-1,1-biphenyl, 2,2 ,3,4 ,6-Pentachloro-4-(methylsulfonyl)biphenyl
Technical Specifications
| Molecular Formula | C13H7Cl5O2S |
| Molecular Weight | 401.86093 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 401.86093 Da |
| Heavy Atoms | 21 |
| Complexity | 466.0 |
| SMILES | CS(=O)(=O)C1=CC(=C(C(=C1Cl)Cl)C2=C(C=C(C=C2)Cl)Cl)Cl |
| InChIKey | BHVPZQWKLQRCFN-UHFFFAOYSA-N |
Chemical Property Profile of 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-
Property Insights of 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-
The XLogP value of 5.6 indicates that 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-?
The CAS number of 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- is 149949-87-1.
What is the molecular formula of 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-?
The molecular formula of 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- is C13H7Cl5O2S.
What is the molecular weight of 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-?
The molecular weight of 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- is 401.86093 g/mol.
Where can I buy 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-?
You can request a quote for 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)-?
Yes, CoreyChem provides custom synthesis services for 1,1'-Biphenyl, 2,2',3,4',6-pentachloro-4-(methylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.