1-(3-Chloro-4-ethoxyphenyl)ethanone

Base Information

• Chemical Name: 1-(3-Chloro-4-ethoxyphenyl)ethanone
• CAS No.: 37612-59-2
• Molecular Formula: C₁₀H₁₁ClO₂
• Molecular Weight: 198.649
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID30486772
• Wikidata: Q82328211
• Mol file: 37612-59-2.mol

Synonyms:1-(3-chloro-4-ethoxyphenyl)ethanone;37612-59-2;1-(3-chloro-4-ethoxyphenyl)ethan-1-one;SCHEMBL8204769;DTXSID30486772;MFCD09754928;AKOS000296240;BS-4100;FT-0679240

Chemical Property of 1-(3-Chloro-4-ethoxyphenyl)ethanone

Chemical Property:

• Vapor Pressure: 0.000641mmHg at 25°C
• Refractive Index: 1.517
• Boiling Point: 309.4°C at 760 mmHg
• Flash Point: 132.1°C
• PSA: 26.30000
• Density: 1.145g/cm³
• LogP: 2.94130
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 198.0447573
• Heavy Atom Count: 13
• Complexity: 182

Purity/Quality:

98%min ^*data from raw suppliers

1-(3-Chloro-4-ethoxyphenyl)ethanone 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C(C=C(C=C1)C(=O)C)Cl

Technology Process of 1-(3-Chloro-4-ethoxyphenyl)ethanone

There total 3 articles about 1-(3-Chloro-4-ethoxyphenyl)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:

4'-ethoxyacetophenone (1676-63-7) → 1-(4-ethoxy-3-chloro-phenyl)-ethanone (37612-59-2)

Guidance literature:

With sodium persulfate; tris(bipyridine)ruthenium(II) dichloride hexahydrate; sodium chloride; In water; acetonitrile; at 25 ℃; for 15h; Irradiation;

DOI:10.1039/c7sc03010j

Reference yield:

1-chloro-2-ethoxybenzene (614-72-2) + acetyl chloride (75-36-5) → 1-(4-ethoxy-3-chloro-phenyl)-ethanone (37612-59-2)

Guidance literature:

With aluminium trichloride;

Reference yield:

→ 1-(4-ethoxy-3-chloro-phenyl)-ethanone (37612-59-2)

Guidance literature:

Entspr. 4-Hydroxy-Verb., Ethyljodid;

upstream raw materials:

1-chloro-2-ethoxybenzene

acetyl chloride

4'-ethoxyacetophenone

Downstream raw materials:

2-(4-ethoxy-3-chloro-phenyl)-quinoline-4-carboxylic acid

C₁₁H₁₄ClN₃O₂

3-(3-chloro-4-ethoxy-phenyl)-1H-pyrazole-4-carbaldehyde

3-(3-chloro-4-ethoxy-phenyl)-1H-pyrazole-4-carboxylic acid

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