2-(Chloromethyl)benzene-1-sulfonyl chloride

Base Information

• Chemical Name: 2-(Chloromethyl)benzene-1-sulfonyl chloride
• CAS No.: 31910-66-4
• Molecular Formula: C7H6Cl2O2S
• Molecular Weight: 225.09200
• European Community (EC) Number: 829-095-4
• DSSTox Substance ID: DTXSID60496667
• Wikidata: Q82345678
• Mol file: 31910-66-4.mol

Synonyms:31910-66-4;2-(Chloromethyl)benzene-1-sulfonyl chloride;2-(chloromethyl)benzenesulfonyl chloride;Benzenesulfonyl chloride, 2-(chloromethyl)-;SCHEMBL10641975;DTXSID60496667;YHZUBQWOGUKTNZ-UHFFFAOYSA-N;AKOS006335970;2-(Chloromethyl)benzene-1-sulfonylchloride;EN300-189391

Chemical Property of 2-(Chloromethyl)benzene-1-sulfonyl chloride

Chemical Property:

• Melting Point: 46 °C
• Boiling Point: 175 °C(Press: 22 Torr)
• PSA: 42.52000
• Density: 1.463±0.06 g/cm3(Predicted)
• LogP: 3.43370
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 223.9465560
• Heavy Atom Count: 12
• Complexity: 232

Purity/Quality:

99% ^*data from raw suppliers

2-(chloromethyl)benzene-1-sulfonylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)CCl)S(=O)(=O)Cl

Technology Process of 2-(Chloromethyl)benzene-1-sulfonyl chloride

There total 2 articles about 2-(Chloromethyl)benzene-1-sulfonyl 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:

3H-benzo[c][1,2]oxathiole 1-oxide (31910-65-3) → 2-chloromethyl-benzenesulfonyl chloride (31910-66-4)

Guidance literature:

With chlorine; In dichloromethane;

DOI:10.1139/v71-154

Reference yield:

→ 2-chloromethyl-benzenesulfonyl chloride (31910-66-4)

Guidance literature:

With chlorine; phosphorus trichloride; at 110 - 130 ℃;

DOI:10.1039/jr9320002042

Reference yield:

2-chloromethyl-benzenesulfonyl chloride (31910-66-4) → 2-(chloromethyl)benzene sulfonamide (81629-77-8)

Guidance literature:

With ammonia; In tetrahydrofuran;

upstream raw materials:

3H-benzo[c][1,2]oxathiole 1-oxide

Downstream raw materials:

2-[4-(1,1-dioxo-1,3-dihydro-1λ⁶-benzo[d]isothiazol-2-yl)-phenyl]-propionic acid ethyl ester

2-[4-(1,1-dioxo-1,3-dihydro-1λ⁶-benzo[d]isothiazol-2-yl)-phenyl]-propionic acid

2-(chloromethyl)benzene sulfonamide

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