1,3-Benzenedisulfonyl chloride

Base Information

• Chemical Name: 1,3-Benzenedisulfonyl chloride
• CAS No.: 585-47-7
• Molecular Formula: C6H4 Cl2 O4 S2
• Molecular Weight: 275.133
• Hs Code.: 29049090
• European Community (EC) Number: 209-556-0
• NSC Number: 61429
• UNII: 29M4XRF3V2
• DSSTox Substance ID: DTXSID3060407
• Nikkaji Number: J62.915D
• Wikidata: Q81989092
• Mol file: 585-47-7.mol

Synonyms:585-47-7;1,3-Benzenedisulfonyl chloride;Benzene-1,3-disulfonyl dichloride;1,3-Benzenedisulfonyl dichloride;Benzene-1,3-disulfonyl chloride;m-Benzenedisulfonyl chloride;m-Benzenedisulfonyl dichloride;m-Phenylenedisulfonyl chloride;3-Chlorosulfonylbenzenesulfonyl chloride;Benzene-1,3-di(sulphonyl chloride);29M4XRF3V2;EINECS 209-556-0;MFCD00041879;NSC 61429;NSC-61429;benzene-1,3-disulfonylchloride;UNII-29M4XRF3V2;SCHEMBL56599;1,3-bis(chlorosulfonyl)benzene;1,3-benzenedisulphonyl chloride;1,3-benzene-disulfonyl chloride;DTXSID3060407;ALIQZUMMPOYCIS-UHFFFAOYSA-;C6-H4-Cl2-O4-S2;benzene-1,3-di(sulfonyl chloride);benzene-1,3-disulphonyl dichloride;NSC61429;BBL102124;GEO-03722;STL555923;1,3-benzenedisulfonic acid dichloride;AKOS003273139;FS-4241;PB43111;1,3-BIS(CHLOROSULPHONYL)BENZENE;Benzene-1,3-disulfonyl chloride, 97%;1,3-BENZENEDISULPHONYL DICHLORIDE;6-methoxy-chroman-3-ylaminehydrochloride;SY049361;AM20040782;B0848;CS-0043297;FT-0606543;A24506;D72697;EN300-151861;Benzene-1,3-disulphonyl dichloride

Chemical Property of 1,3-Benzenedisulfonyl chloride

Chemical Property:

• Appearance/Colour: Light Brown Solid
• Vapor Pressure: 2.7E-06mmHg at 25°C
• Melting Point: 57-60 °C(lit.)
• Refractive Index: 1.578
• Boiling Point: 145 °C / 1mmHg
• Flash Point: 196.7°C
• PSA: 85.04000
• Density: 1.69
• LogP: 3.70320
• Storage Temp.: Refrigerator
• Sensitive.: Moisture Sensitive
• Solubility.: Dichloromethane, DMSO
• Water Solubility.: Soluble in DMSO and methanol. Reacts with water.
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 273.8928063
• Heavy Atom Count: 14
• Complexity: 351

Purity/Quality:

99% ^*data from raw suppliers

Benzene-1,3-disulfonyl chloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34-37-42/43
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)S(=O)(=O)Cl)S(=O)(=O)Cl
• Uses: 1,3-Benzenedisulfonyl chloride is used as a pharmaceutical intermediates.

Technology Process of 1,3-Benzenedisulfonyl chloride

There total 13 articles about 1,3-Benzenedisulfonyl 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: 96.0%

1,3-benzenedisulfonic acid disodium salt (831-59-4) → benzene-1,3-disulfonyl chloride (585-47-7)

Guidance literature:

With thionyl chloride; for 0.333333h; Reagent/catalyst; Reflux;

Reference yield: 67.0%

benzenesulfonyl chloride (98-09-9) → benzene-1,3-disulfonyl chloride (585-47-7)

Guidance literature:

With chlorosulfonic acid; sulfuric acid; at 145 ℃; for 16h;

Reference yield: 65.8%

2-hydroxypyridin (142-08-5) + benzene-1,3-di[N-sulfonyl-L-alanyloxy chloride] → benzene-1,3-disulfonyl chloride (585-47-7) + benzene-1,3-di[N-sulfonyl-L-alanyloxy-2-pyridine]

Guidance literature:

With sodium hydrogencarbonate; In pyridine; chloroform; water;

upstream raw materials:

3-mercaptothiophenol

benzene

1,3-benzenedisulfonic acid disodium salt

sodium phenylsulfonate

Downstream raw materials:

1,3-bis[N,N-bis[2-(tert-butyldimethylsilyloxy)ethyl]sulfamoyl]benzene

benzene-1,3-disulfonamide

N,N'-dimethyl-benzene-1,3-disulfonamide

1,3-benzenedisulfonamide-N,N'-bis(diphenyl)

Refernces

• 1、 Alavinia, Sedigheh,Ghorbani-Vaghei, Ramin,Rakhtshah, Jamshid,Yousefi Seyf, Jaber,Ali Arabian, Iman. "Copper iodide nanoparticles-decorated porous polysulfonamide gel: As effective catalyst for decarboxylative synthesis of N-Arylsulfonamides". . . Retrieved 2020/01/22.
• 2、 Ghorbani-Vaghei, Ramin,Amiri, Mostafa,Veisi, Hojat. "A general simple methodology for synthesis of isonitriles using benzene-1,3-disulfonyl dichloride". . p. 37 - 41. Retrieved 2013/07/26.