Flusulfamide

Base Information

• Chemical Name: Flusulfamide
• CAS No.: 106917-52-6
• Deprecated CAS: 1135443-44-5
• Molecular Formula: C13H7Cl2F3N2O4S
• Molecular Weight: 415.177
• Hs Code.: 29350090
• European Community (EC) Number: 600-788-1
• UNII: LKO7028G4U
• DSSTox Substance ID: DTXSID9057929
• Nikkaji Number: J429.816K
• Wikidata: Q1434379
• ChEMBL ID: CHEMBL2272398
• Mol file: 106917-52-6.mol

Synonyms:flusulfamide

Chemical Property of Flusulfamide

Chemical Property:

• Vapor Pressure: 4.62E-10mmHg at 25°C
• Melting Point: 168～173℃
• Refractive Index: 1.598
• Boiling Point: 498.2 °C at 760 mmHg
• PKA: 4.74±0.10(Predicted)
• Flash Point: 255.1 °C
• PSA: 100.37000
• Density: 1.675 g/cm³
• LogP: 6.39820
• Storage Temp.: 0-6°C
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 413.9455678
• Heavy Atom Count: 25
• Complexity: 594

Purity/Quality:

98% ^*data from raw suppliers

Flusulfamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C=C1[N+](=O)[O-])Cl)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F
• Uses: Flusulfamide is a fungicide used in pesticide formulations in the treatment of crops.

Technology Process of Flusulfamide

There total 1 articles about Flusulfamide 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: 91.0%

4-chloro-3-(trifluoromethyl)benzenesulfonamide (406233-17-8) + 3-chloro-4-fluoronitrobenzene (350-30-1) → 2',6-dichloro-α,α,α-trifluoro-4'-nitro-m-toluenesulfonanilide (106917-52-6)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 140 ℃; for 0.2h; Microwave irradiation;

DOI:10.1016/j.tetlet.2019.01.041

upstream raw materials:

4-chloro-3-(trifluoromethyl)benzenesulfonamide

3-chloro-4-fluoronitrobenzene

Refernces