Bis(4-fluoro-3-nitrophenyl) sulfone

Base Information

• Chemical Name: Bis(4-fluoro-3-nitrophenyl) sulfone
• CAS No.: 312-30-1
• Molecular Formula: C12H6 F2 N2 O6 S
• Molecular Weight: 344.252
• Hs Code.: 2904909090
• European Community (EC) Number: 206-224-7
• NSC Number: 14153
• UNII: DBR958H7K9
• DSSTox Substance ID: DTXSID7059800
• Nikkaji Number: J54.362D
• Wikidata: Q72445811
• ChEMBL ID: CHEMBL297905
• Mol file: 312-30-1.mol

Synonyms:4,4'-difluoro-3,3'-dinitrodiphenylsulfone;DFDNPS;difluorodinitrobenzene sulfone

Chemical Property of Bis(4-fluoro-3-nitrophenyl) sulfone

Chemical Property:

• Melting Point: 191-194 °C(lit.)
• Boiling Point: 531.7°Cat760mmHg
• Flash Point: 275.3°C
• PSA: 134.16000
• Density: 1.64g/cm³
• LogP: 4.74120
• Storage Temp.: 2-8°C
• Solubility.: almost transparency in Acetonitrile
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 343.99146341
• Heavy Atom Count: 23
• Complexity: 526

Purity/Quality:

98%,99%, ^*data from raw suppliers

Bis(4-fluoro-3-nitrophenyl) Sulfone ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])[N+](=O)[O-])F

Technology Process of Bis(4-fluoro-3-nitrophenyl) sulfone

There total 3 articles about Bis(4-fluoro-3-nitrophenyl) sulfone 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(p-fluorophenyl)sulfone (383-29-9) → 3,3'-dinitro-4,4'-difluorodiphenyl sulphone (312-30-1)

Guidance literature:

With sulfuric acid; nitric acid;

Reference yield:

fluorobenzene (462-06-6) → 3,3'-dinitro-4,4'-difluorodiphenyl sulphone (312-30-1)

Guidance literature:

Multi-step reaction with 2 steps

1: aluminium chloride

2: sulfuric acid; nitric acid

With aluminium trichloride; sulfuric acid; nitric acid;

Reference yield:

4-Fluorobenzenesulfonyl chloride (349-88-2) → 3,3'-dinitro-4,4'-difluorodiphenyl sulphone (312-30-1)

Guidance literature:

Multi-step reaction with 2 steps

1: aluminium chloride

2: sulfuric acid; nitric acid

With aluminium trichloride; sulfuric acid; nitric acid;

upstream raw materials:

bis(p-fluorophenyl)sulfone

fluorobenzene

4-Fluorobenzenesulfonyl chloride

Downstream raw materials:

bis-(4-imidazol-1-yl-3-nitro-phenyl)-sulfone

3,3'-diamino-4,4'-difluorodiphenyl sulphone

bis(4-ethylamino-3-nitrophenyl) sulfone

3-amino-4-(4-chloro-2-iodophenoxy)phenyl sulfone