2-Bromo-2-chloro-1-(2,4-dichlorophenyl)ethenyl dimethyl phosphate

Base Information

• Chemical Name: 2-Bromo-2-chloro-1-(2,4-dichlorophenyl)ethenyl dimethyl phosphate
• CAS No.: 52899-13-5
• Molecular Formula: C₁₀H₉BrCl₃O₄P
• Molecular Weight: 410.416
• DSSTox Substance ID: DTXSID401031531
• Wikidata: Q76150580

Synonyms:BRN 2005881;2-Bromo-2-chloro-1-(2,4-dichlorophenyl)ethenyl dimethyl phosphate;Phosphoric acid, 2-bromo-2-chloro-1-(2,4-dichlorophenyl)ethenyl dimethyl ester;52899-13-5;DTXSID401031531;LS-107500;(Z)-2-Bromo-2-chloro-1-(2,4-dichlorophenyl)vinyl dimethyl phosphate

Chemical Property of 2-Bromo-2-chloro-1-(2,4-dichlorophenyl)ethenyl dimethyl phosphate

Chemical Property:

• Vapor Pressure: 1.9E-05mmHg at 25°C
• Boiling Point: 373.7°Cat760mmHg
• Flash Point: 179.8°C
• Density: 1.697g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 407.84874
• Heavy Atom Count: 19
• Complexity: 385

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COP(=O)(OC)OC(=C(Cl)Br)C1=C(C=C(C=C1)Cl)Cl
• Isomeric SMILES: COP(=O)(OC)O/C(=C(/Cl)\Br)/C1=C(C=C(C=C1)Cl)Cl

Technology Process of 2-Bromo-2-chloro-1-(2,4-dichlorophenyl)ethenyl dimethyl phosphate

There total 2 articles about 2-Bromo-2-chloro-1-(2,4-dichlorophenyl)ethenyl dimethyl phosphate 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:

2,2',4'-trichloroacetophenone (4252-78-2) → Phosphoric acid (Z)-2-bromo-2-chloro-1-(2,4-dichloro-phenyl)-vinyl ester dimethyl ester (52899-13-5)

Guidance literature:

Multi-step reaction with 2 steps

1: Br₂ / CCl₄

With bromine; In tetrachloromethane;

Reference yield:

2,4,α-Trichlor-α,α-dibromacetophenon (61622-11-5) + phosphorous acid trimethyl ester (121-45-9) → Phosphoric acid (Z)-2-bromo-2-chloro-1-(2,4-dichloro-phenyl)-vinyl ester dimethyl ester (52899-13-5)

Guidance literature:

upstream raw materials:

2,4,α-Trichlor-α,α-dibromacetophenon

phosphorous acid trimethyl ester

2,2',4'-trichloroacetophenone

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