1-Chloro-4-(2-chloro-2-phenylethanesulfonyl)benzene

Base Information

• Chemical Name: 1-Chloro-4-(2-chloro-2-phenylethanesulfonyl)benzene
• CAS No.: 1854-84-8
• Molecular Formula: C14H12Cl2O2S
• Molecular Weight: 315.22
• DSSTox Substance ID: DTXSID80504435
• Mol file: 1854-84-8.mol

Synonyms:1854-84-8;1-Chloro-4-(2-chloro-2-phenylethanesulfonyl)benzene;DTXSID80504435

Chemical Property of 1-Chloro-4-(2-chloro-2-phenylethanesulfonyl)benzene

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 313.9935062
• Heavy Atom Count: 19
• Complexity: 363

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(CS(=O)(=O)C2=CC=C(C=C2)Cl)Cl

Technology Process of 1-Chloro-4-(2-chloro-2-phenylethanesulfonyl)benzene

There total 4 articles about 1-Chloro-4-(2-chloro-2-phenylethanesulfonyl)benzene which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 97.0%

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + 4-chlorobenzenesulfonyl chloride (98-60-2) → 1-chloro-4-((2-chloro-2-phenylethyl)sulfonyl)benzene (1854-84-8)

Guidance literature:

With C₅₉H₅₂CuN₂OP₂⁽¹⁺⁾*F₆P^(1-); In dichloromethane; acetonitrile; at 20 ℃; for 24h; Sealed tube; Irradiation; Glovebox; Inert atmosphere;

DOI:10.1021/acs.joc.9b00238

Reference yield: 58.0%

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + p-chlorobenzenediazonium tetrafluoroborate (673-41-6) → 1-chloro-4-((2-chloro-2-phenylethyl)sulfonyl)benzene (1854-84-8)

Guidance literature:

With copper(I) 2-hydroxy-3-methylbenzoate; 2,2'-biquinoline; sulfur dioxide; lithium chloride; In 2-methyltetrahydrofuran; at 60 ℃; for 16h; regioselective reaction; Inert atmosphere; Sealed tube;

DOI:10.1021/acs.orglett.1c02001

Reference yield:

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + 4-chloro-aniline (106-47-8) → 1-chloro-4-((2-chloro-2-phenylethyl)sulfonyl)benzene (1854-84-8)

Guidance literature:

With hydrogenchloride; copper chloride; sulfur dioxide; sodium nitrite; Yield given. Multistep reaction; 1) glacial acetic acid; 2) acetic acid-acetone, 15-20 deg C;

upstream raw materials:

styrene

4-chlorobenzenesulfonyl chloride

4-chloro-aniline

p-chlorobenzenediazonium tetrafluoroborate

Downstream raw materials:

α-(4-Chlor-benzol-sulfonyl)-styrol