1-(5-Chloro-2-methoxyphenyl)ethanone

Base Information

• Chemical Name: 1-(5-Chloro-2-methoxyphenyl)ethanone
• CAS No.: 6342-64-9
• Molecular Formula: C9H9ClO2
• Molecular Weight: 184.622
• Hs Code.: 2914700090
• European Community (EC) Number: 673-608-2
• NSC Number: 46629
• DSSTox Substance ID: DTXSID50286594
• Nikkaji Number: J1.871.573B
• Wikidata: Q72452959
• Mol file: 6342-64-9.mol

Synonyms:1-(5-Chloro-2-methoxyphenyl)ethanone;6342-64-9;5-Chloro-2-methoxyacetophenone;5'-Chloro-2'-methoxyacetophenone;1-(5-chloro-2-methoxyphenyl)ethan-1-one;NSC46629;Ethanone, 1-(5-chloro-2-methoxyphenyl)-;SCHEMBL364764;DTXSID50286594;2'-Methoxy-5'-chloroacetophenone;AM1115;MFCD00174339;NSC 46629;NSC-46629;STK661647;AKOS000295787;FS-1582;1-(5-chloro-2-methoxy-phenyl)-ethanone;NCGC00325575-01;1-(5-chloranyl-2-methoxy-phenyl)ethanone;1-(5-chloro-2-methoxyphenyl)-1-ethanone;CS-0144573;FT-0636106;EN300-14420;D97582;AB01320877-02;A834369;Z54601467

Chemical Property of 1-(5-Chloro-2-methoxyphenyl)ethanone

Chemical Property:

• Vapor Pressure: 0.00434mmHg at 25°C
• Melting Point: 29-30 °C
• Refractive Index: 1.521
• Boiling Point: 278.1 °C at 760 mmHg
• Flash Point: 120.1 °C
• PSA: 26.30000
• Density: 1.176 g/cm³
• LogP: 2.55120
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 184.0291072
• Heavy Atom Count: 12
• Complexity: 170

Purity/Quality:

98%min ^*data from raw suppliers

1-(5-Chloro-2-methoxyphenyl)ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=C(C=CC(=C1)Cl)OC

Technology Process of 1-(5-Chloro-2-methoxyphenyl)ethanone

There total 15 articles about 1-(5-Chloro-2-methoxyphenyl)ethanone 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: 93.0%

5-chloro-2-hydroxyacetophenone (1450-74-4) + methyl iodide (74-88-4) → 2-methoxy-5-chloroacetophenone (6342-64-9)

Guidance literature:

With potassium carbonate; In DMF (N,N-dimethyl-formamide); at 20 ℃;

Reference yield: 87.0%

5-chloro-2-hydroxyacetophenone (1450-74-4) + dimethyl sulfate (77-78-1) → 2-methoxy-5-chloroacetophenone (6342-64-9)

Guidance literature:

With tetra-(n-butyl)ammonium iodide; potassium carbonate; In acetone; for 3h; Reflux;

DOI:10.1002/jccs.201500201

Reference yield: 79.0%

5-chloro-2-hydroxyacetophenone (1450-74-4) → 2-methoxy-5-chloroacetophenone (6342-64-9)

Guidance literature:

With potassium carbonate; methyl iodide; In acetonitrile; at 85 ℃; for 18h;

upstream raw materials:

4-chloromethoxybenzene

acetyl chloride

acetic anhydride

5-chloro-2-hydroxyacetophenone

Downstream raw materials:

5-(5-Chloro-2-methoxy-phenyl)-5-methyl-imidazolidine-2,4-dione

1-(5-chloro-2-methoxy-phenyl)-butane-1,3-dione

C₁₁H₁₂ClNO₂

C₁₇H₁₁ClO₄

Refernces

• 1、 Bouhedja, Mourad,Peres, Basile,Fhayli, Wassim,Ghandour, Zeinab,Boumendjel, Ahcène,Faury, Gilles,Khelili, Smail. "Design, synthesis and biological evaluation of novel ring-opened cromakalim analogues with relaxant effects on vascular and respiratory smooth muscles and as stimulators of elastin synthesis". . p. 774 - 796. Retrieved 2018/01/05.
• 2、 Dalal, Aarti,Kumar, Dinesh,Kamboj, Ramesh C. "Photolysis of α,β-Epoxyketones: A Green Synthesis of β-Hydroxyenones through Tandem H-Abstraction, Ring Cleavage and Isomerisation". . p. 1114 - 1120. Retrieved 2016/01/26.