Dichlofluanid

Base Information

• Chemical Name: Dichlofluanid
• CAS No.: 1085-98-9
• Deprecated CAS: 12698-56-5,56590-61-5,79235-99-7,90416-56-1
• Molecular Formula: C9H11 Cl2 F N2 O2 S2
• Molecular Weight: 333.235
• European Community (EC) Number: 214-118-7
• NSC Number: 218451
• UNII: 76A92XU36Y
• DSSTox Substance ID: DTXSID5041851
• Nikkaji Number: J3.361H
• Wikipedia: Dichlofluanid
• Wikidata: Q421444
• Metabolomics Workbench ID: 123079
• ChEMBL ID: CHEMBL1269177
• Mol file: 1085-98-9.mol

Synonyms:Bay 47531;dichlofluanid;Euparen;N-((dichlorofluoromethyl)thio)-N',N'-dimethyl-N-phenylsulfamide

Chemical Property of Dichlofluanid

Chemical Property:

• Vapor Pressure: 0.00011mmHg at 25°C
• Melting Point: 105.6℃
• Refractive Index: 1.616
• Boiling Point: 336.8 ºC at 760 mmHg
• PKA: -5.37±0.50(Predicted)
• Flash Point: 157.5ºC
• PSA: 74.30000
• Density: 1.553 g/cm₃
• LogP: 4.08680
• Storage Temp.: APPROX 4°C
• Water Solubility.: 1.3 mg l-1
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 331.9623035
• Heavy Atom Count: 18
• Complexity: 367

Purity/Quality:

99.9% ^*data from raw suppliers

Dichlofluanid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): XnNF
• Hazard Codes: Xn,N,F
• Statements: 20-36-43-50/53-20/21/22-11-50
• Safety Statements: 24-37-60-61-36-26-16-36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Pesticides -> Fungicides
• Canonical SMILES: CN(C)S(=O)(=O)N(C1=CC=CC=C1)SC(F)(Cl)Cl
• Description: Dichlofluanid is solid sparingly soluble in water, soluble in most organic solvents, and decomposes in alkaline media.
• Uses: Fungicide. Dichlofluanid is used to control a wide range of fungal diseases including storage diseases on many crops.

Technology Process of Dichlofluanid

There total 3 articles about Dichlofluanid 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: 84.2%

N,N-dimethyl-N'-phenylsulfonamide (4710-17-2) + dichlorofluoromethanesulphenyl chloride (2712-93-8) → N-dichlorofluoromethylthio-N',N'-dimethyl-N-phenylsulfamide (1085-98-9)

Guidance literature:

N,N-dimethyl-N'-phenylsulfonamide; With sodium hydride; In toluene; at 0 - 20 ℃; for 1h;

dichlorofluoromethanesulphenyl chloride; In toluene; at 20 ℃;

Reference yield:

N,N-dimethyl-N'-phenylsulfonamide (4710-17-2) + triethylamine (121-44-8) + dichlorofluoromethanesulphenyl chloride (2712-93-8) → N-dichlorofluoromethylthio-N',N'-dimethyl-N-phenylsulfamide (1085-98-9)

Guidance literature:

Reference yield:

→ N-dichlorofluoromethylthio-N',N'-dimethyl-N-phenylsulfamide (1085-98-9)

Guidance literature:

aus Anilino-dimethylamino-sulfon, Cl2FC-SCl;

upstream raw materials:

N,N-dimethyl-N'-phenylsulfonamide

triethylamine

dichlorofluoromethanesulphenyl chloride

Refernces

• 1、 -. "Synergistic Combinations Of Active Ingredients". . . Retrieved 2012/02/15.
• 2、 -. "Preservative for aqueous products and systems". . . Retrieved 2008/06/13.