3-Fluoro-4-methylbenzenesulfonyl chloride

Base Information

• Chemical Name: 3-Fluoro-4-methylbenzenesulfonyl chloride
• CAS No.: 90260-13-2
• Molecular Formula: C7H6ClFO2S
• Molecular Weight: 208.641
• Hs Code.: 2904909090
• European Community (EC) Number: 626-184-8
• DSSTox Substance ID: DTXSID40381022
• Wikidata: Q72474444
• Mol file: 90260-13-2.mol

Synonyms:90260-13-2;3-Fluoro-4-methylbenzenesulfonyl chloride;3-fluoro-4-methylbenzene-1-sulfonyl chloride;3-fluoro-4-methylbenzenesulphonyl chloride;3-fluoro-4-methylbenzenesulfonylchloride;Benzenesulfonyl chloride, 3-fluoro-4-methyl-;3-fluoro-p-toluenesulphonyl chloride;MFCD03094389;3-fluoro-4-methylphenylsulfonyl chloride;3-fluoro-4-methyl-benzenesulfonyl Chloride;3-FLUORO-P-TOLUENESULFONYL CHLORIDE;SCHEMBL18593;DTXSID40381022;YDUHIMCRFRIVFI-UHFFFAOYSA-N;BBL100045;STL511021;AKOS000143264;AM62535;AS-47791;3-Fluoro-4-methyl benzenesulfonyl chloride;3-fluoro-4-methylbenzene-1-sulfonylchloride;FT-0615692;EN300-39544;F16156;3-Fluoro-4-methylbenzenesulfonyl chloride, 97%;Z228589110

Chemical Property of 3-Fluoro-4-methylbenzenesulfonyl chloride

Chemical Property:

• Appearance/Colour: White solid
• Vapor Pressure: 0.022mmHg at 25°C
• Melting Point: 46-50 °C(lit.)
• Refractive Index: 1.528
• Boiling Point: 258.6 °C at 760 mmHg
• Flash Point: 110.2 °C
• PSA: 42.52000
• Density: 1.423 g/cm³
• LogP: 3.14240
• Storage Temp.: 2-8°C
• Sensitive.: Moisture Sensitive
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 207.9761065
• Heavy Atom Count: 12
• Complexity: 247

Purity/Quality:

99% ^*data from raw suppliers

3-Fluoro-4-methylbenzenesulfonyl chloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C,Xi
• Hazard Codes: C,Xi
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)S(=O)(=O)Cl)F
• Uses: 3-Fluoro-4-methylbenzenesulfonyl Chloride can be prepared to use as GCN2 modulators to treat, prevent, ameliorate, control, or reduce disorders related to GCN2.

Technology Process of 3-Fluoro-4-methylbenzenesulfonyl chloride

There total 1 articles about 3-Fluoro-4-methylbenzenesulfonyl chloride 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:

→ 3-fluoro-4-methylbenzene-1-sulfonyl chloride (90260-13-2)

Guidance literature:

Reference yield: 100.0%

3-fluoro-4-methylbenzene-1-sulfonyl chloride (90260-13-2) → 3-fluoro-4-methylbenzene-1-sulfonamide (329909-29-7)

Guidance literature:

at 20 ℃; for 4h;

Reference yield: 89.0%

3-fluoro-4-methylbenzene-1-sulfonyl chloride (90260-13-2) + diallylamine (124-02-7) → N,N-diallyl-3-fluoro-4-methylbenzenesulfonamide

Guidance literature:

diallylamine; With triethylamine; In dichloromethane; at 0 ℃; for 0.5h;

3-fluoro-4-methylbenzene-1-sulfonyl chloride; In dichloromethane; at 20 ℃;

DOI:10.1055/s-0039-1690002

Downstream raw materials:

3-fluoro-4-methylbenzene-1-sulfonamide

4-(Bromomethyl)-3-fluorobenzenesulfonyl chloride

tert-butyl ({1-[(3-fluoro-4-methylphenyl)sulfonyl]-5-(2-fluoropyridin-3-yl)-1H-pyrrol-3-yl}methyl)methylcarbamate

methyl 3-(3-fluoro-4-methylphenylsulfonamido)thiophene-2-carboxylate

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