1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one

Base Information

• Chemical Name: 1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one
• CAS No.: 119851-28-4
• Molecular Formula: C14H10Cl2O2
• Molecular Weight: 281.138
• Hs Code.: 2914700090
• European Community (EC) Number: 601-639-3
• DSSTox Substance ID: DTXSID20350372
• Nikkaji Number: J2.651.268I
• Wikidata: Q72517800
• Mol file: 119851-28-4.mol

Synonyms:119851-28-4;1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one;1-[2-chloro-4-(4-chlorophenoxy)phenyl]ethanone;2'-Chloro-4'-(4-chlorophenoxy)acetophenone;4-Acetyl-3,4'-dichlorodiphenylether;Ethanone, 1-[2-chloro-4-(4-chlorophenoxy)phenyl]-;1-(2-CHLORO-4-(4-CHLOROPHENOXY)PHENYL)ETHANONE;EC 601-639-3;1-(2-Chloro-4-(4-chloro-phenoxy)-phenyl)-ethanone;1-(2-chloro-4-(4-chlorophenoxy)phenyl)ethan-1-one;MFCD00140226;2-chloro-4-(4-chlorophenoxy)acetophenone;1-[2-chloro-4-(4-chloro-phenoxy)-phenyl]-ethanone;4-Acetyl-3,4'-dichlorodiphenyl Ether;SCHEMBL4117335;DTXSID20350372;STR01032;AKOS001484656;AC-8783;CS-W010049;SY009658;4'-(p-chlorophenoxy)-2'-chloroacetophenone;4-(4-chlorophenoxy)-2 chlorophenyl ethanone;AM20020280;C2219;EU-0068064;FT-0611735;FT-0649290;I10029;11D-069;A804375;SR-01000399432;1-[2-chloro-4-(4-chlorophenoxy)phenyl]-1-ethanone;SR-01000399432-1;2 inverted exclamation mark -Chloro-4 inverted exclamation mark -(4-chlorophenoxy)acetophenone

Chemical Property of 1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one

Chemical Property:

• Appearance/Colour: light yellow to dark yellow liquid
• Vapor Pressure: 1.2E-05mmHg at 25°C
• Melting Point: 54-56 ºC
• Refractive Index: 1.588
• Boiling Point: 369.2 ºC at 760 mmHg
• Flash Point: 146.5 ºC
• PSA: 26.30000
• Density: 1.304 g/cm³
• LogP: 4.98830
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Solubility.: soluble in Methanol
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 280.0057849
• Heavy Atom Count: 18
• Complexity: 288

Purity/Quality:

99% ^*data from raw suppliers

1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=C(C=C(C=C1)OC2=CC=C(C=C2)Cl)Cl
• Uses: 1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one serves as a reactant in the prepn. of a fungicide that targets plant pathogenic fungi.

Technology Process of 1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one

There total 6 articles about 1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one 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: 90.1%

3,4'-Dichlorobiphenyl ether (6842-62-2) + acetyl chloride (75-36-5) → 1-(2-chloro-4-(4-chlorophenoxy)phenyl)-ethan-1-one (119851-28-4)

Guidance literature:

With aluminum (III) chloride; In 1,2-dichloro-ethane; for 4h;

Reference yield: 90.0%

2'-chloro-4'-fluoroacetophenone (700-35-6) + 4-chloro-phenol (106-48-9,82344-39-6) → 1-(2-chloro-4-(4-chlorophenoxy)phenyl)-ethan-1-one (119851-28-4)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 115 ℃; for 8h;

Reference yield:

1,3-Dichlorobenzene (541-73-1) → 1-(2-chloro-4-(4-chlorophenoxy)phenyl)-ethan-1-one (119851-28-4)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate; copper(l) chloride / N,N-dimethyl-formamide / Reflux

2: aluminum (III) chloride / 1,2-dichloro-ethane / 4 h

With aluminum (III) chloride; potassium carbonate; copper(l) chloride; In 1,2-dichloro-ethane; N,N-dimethyl-formamide;

upstream raw materials:

2'-chloro-4'-fluoroacetophenone

4-chloro-phenol

1-bromo-2-chloro-4-(4-chlorophenoxy)benzene

acetyl chloride

Downstream raw materials:

2-[2-chloro-4 (4-chlorophenoxy)phenyl]-2-oxo-ethyl methanesulfonate

C₂₁H₁₆Cl₂O₅S

2-bromo-1-(2-chloro-4-(4-chlorophenoxy)phenyl)ethanone

C₂₁H₁₄Cl₂O₂

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