2,4-Dinitrobenzenesulfenyl chloride

Base Information

• Chemical Name: 2,4-Dinitrobenzenesulfenyl chloride
• CAS No.: 528-76-7
• Molecular Formula: C6H3 Cl N2 O4 S
• Molecular Weight: 234.62
• Hs Code.: 2930909090
• European Community (EC) Number: 208-441-2
• NSC Number: 97092
• UNII: 6XLF60A5YM
• DSSTox Substance ID: DTXSID6060181
• Nikkaji Number: J150.756G
• Wikidata: Q27265679
• Mol file: 528-76-7.mol

Synonyms:2,4-dinitrobenzenesulfenyl chloride;2,4-dinitrophenylsulfenyl chloride

Chemical Property of 2,4-Dinitrobenzenesulfenyl chloride

Chemical Property:

• Vapor Pressure: 3.34E-07mmHg at 25°C
• Melting Point: 94-97 °C(lit.)
• Refractive Index: 1.6000 (estimate)
• Boiling Point: 430.1°C at 760 mmHg
• Flash Point: 213.9°C
• PSA: 116.94000
• Density: 1.68g/cm³
• LogP: 3.79530
• Storage Temp.: Store at RT.
• Solubility.: benzene: soluble
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 233.9502054
• Heavy Atom Count: 14
• Complexity: 241

Purity/Quality:

99% ^*data from raw suppliers

2,4-Dinitrobenzenesulfenyl chloride ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCl
• Uses: 2,4-Dinitrobenzenesulfenyl chloride was used in preparation of chlorine and bromine biphenyls.

Technology Process of 2,4-Dinitrobenzenesulfenyl chloride

There total 10 articles about 2,4-Dinitrobenzenesulfenyl 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:

bis(2,4-dinitrophenyl) disulphide (2217-55-2) → 2,4-dinitrobenzenesulfenyl chloride (528-76-7)

Guidance literature:

With chlorine; iron; 1,2-dichloro-ethane;

DOI:10.1021/ja01160a108

Reference yield:

2,4-dinitrothiophenol (2218-96-4) → 2,4-dinitrobenzenesulfenyl chloride (528-76-7)

Guidance literature:

With tetrachloromethane; chlorine;

DOI:10.1021/ja01149a534

Reference yield:

benzyl-(2,4-dinitro-phenyl)-sulfide (7343-61-5) → 2,4-dinitrobenzenesulfenyl chloride (528-76-7)

Guidance literature:

With sulfuryl dichloride; In 1,2-dichloro-ethane;

DOI:10.1016/j.bmcl.2012.11.103

upstream raw materials:

N-chloro-succinimide

2,4-dinitrothiophenol

bis(2,4-dinitrophenyl) disulphide

S-2,4-dinitrophenyl thiobenzoate

Downstream raw materials:

N-(2,4-Dinitrobenzol-sulfenyl)-piperidin

4-chloro-1-(2,6-dichloro-benzyl)-5-(2,4-dinitro-phenylsulfanyl)-1,4,5,6-tetrahydro-pyridine-3-carboxylic acid amide

2-(2,4-dinitrophenylthio)-1-phenyl-1-chloroethane

dinitrobenzenesulfenic acid methyl ester

Refernces

• 1、 Beaulieu, Pierre L.,Kabo, Ann,Garratt, Dennis G.. "Electrophilic cleavage of cyclopropanes. II. Concerning the effect of increasing electron demand upon the product-determining transition state in the reaction of 4-substituted-2-nitrobenzenesulphenyl chlorides and benzenesulphenyl chlorides with tetracyclo2,7.04,6>heptane....". . p. 1014 - 1020. Retrieved 2007/10/02.