Benzenesulfonamide, N-(4-chlorophenyl)-4-methyl-

Base Information

• Chemical Name: Benzenesulfonamide, N-(4-chlorophenyl)-4-methyl-
• CAS No.: 2903-34-6
• Molecular Formula: C13H12 Cl N O2 S
• Molecular Weight: 281.763
• Hs Code.: 2935009090
• European Community (EC) Number: 220-801-0
• NSC Number: 74681
• DSSTox Substance ID: DTXSID9062693
• Nikkaji Number: J243.078I
• Wikidata: Q81990197
• ChEMBL ID: CHEMBL181809
• Mol file: 2903-34-6.mol

Synonyms:2903-34-6;N-(4-Chlorophenyl)-4-methylbenzenesulfonamide;Benzenesulfonamide, N-(4-chlorophenyl)-4-methyl-;N-(4-CHLOROPHENYL)-P-TOLUENESULFONAMIDE;p-Toluenesulfonanilide, 4'-chloro-;N-(p-Chlorophenyl)-p-toluenesulphonamide;EINECS 220-801-0;NSC 74681;N-(4-chlorophenyl)-4-methylbenzene-1-sulfonamide;NSC74681;Cambridge id 5245596;NCIOpen2_004054;CBDivE_008857;CHEMBL181809;SCHEMBL2136408;DTXSID9062693;4'-chloro-p-toluenesulfonanilide;4'-Chloro-p-toluenesulfonannilide;p-chlorophenyl p-tolyl sulfonamide;2-(4-Nitrophenoxy)ethylmethacrylate;MFCD00145000;NSC-74681;STK414080;AKOS002963381;AB11008;BS-49341;CS-0320542;FT-0703798;AB00076557-01;N-(4-Chlorophenyl)-4-methylbenzenesulfonamide #;AE-848/00888028;SR-01000200669;SR-01000200669-1

Chemical Property of Benzenesulfonamide, N-(4-chlorophenyl)-4-methyl-

Chemical Property:

• Vapor Pressure: 3.75E-07mmHg at 25°C
• Melting Point: 118-122 °C
• Boiling Point: 416.7°Cat760mmHg
• Flash Point: 205.8°C
• PSA: 54.55000
• Density: 1.362g/cm³
• LogP: 4.60300
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 281.0277275
• Heavy Atom Count: 18
• Complexity: 350

Purity/Quality:

99% ^*data from raw suppliers

N-(4-Chlorophenyl)-4-methylbenzenesulfonamide 95+% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Cl

Technology Process of Benzenesulfonamide, N-(4-chlorophenyl)-4-methyl-

There total 54 articles about Benzenesulfonamide, N-(4-chlorophenyl)-4-methyl- 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: 100.0%

4-chloro-aniline (106-47-8) + p-toluenesulfonyl chloride (98-59-9) → 4-methyl-N-(4-chlorophenyl)benzenesulfonamide (2903-34-6)

Guidance literature:

In pyridine; acetonitrile; at 20 ℃; for 16h;

Reference yield: 97.0%

phenyl toluenesulfonamide (68-34-8) → 4-methyl-N-(4-chlorophenyl)benzenesulfonamide (2903-34-6)

Guidance literature:

With N-chloro-succinimide; oxygen; copper dichloride; In acetonitrile; at 100 ℃; for 4h; under 760.051 Torr; regioselective reaction;

DOI:10.1039/c3cc47174h

Reference yield: 95.0%

N,N-dimethyl-1-(p-tolylsulfonyl)pyridin-1-ium-4-amine chloride (72973-25-2) + 4-chloro-aniline (106-47-8) → 4-methyl-N-(4-chlorophenyl)benzenesulfonamide (2903-34-6)

Guidance literature:

In dichloromethane; at 20 ℃; for 0.5h; Solvent; Green chemistry;

DOI:10.1016/j.tetlet.2016.09.010

upstream raw materials:

4-chloro-aniline

p-toluenesulfonyl chloride

ethanol

N¹-Tosyl-N¹-(p-chlorophenyl)-N²-(p-methoxyphenyl)acetamidine

Downstream raw materials:

1,5-bis-[4-chloro-N-(toluene-4-sulfonyl)-anilino]-pentane

N-(4-chlorophenyl)-N,4-dimethylbenzenesulfonamide

N-(4-benzothiazol-2-yl-benzyl)-4-chloro-aniline

4-chloro-aniline

Refernces

• 1、 Zhang, Chenlu,Zhu, Hai,Gang, Kaiyue,Tao, Minli,Ma, Ning,Zhang, Wenqin. "Immobilization of copper(II) into polyacrylonitrile fiber toward efficient and recyclable catalyst in Chan-Lam coupling reactions". . . Retrieved 2021/02/09.
• 2、 Jiang, Xiaolan,Zhang, Kaili,Zhao, Rongrong,Bai, Die,Wang, Jinlong,Li, Binbin,Liu, Qixing,Zhou, Haifeng. "Metal-free one-pot synthesis of N-arylsulfonamides from nitroarenes and sodium sulfinates in an aqueous medium". supporting information. . Retrieved 2020/09/10.