Ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate

Base Information

• Chemical Name: Ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate
• CAS No.: 172168-01-3
• Molecular Formula: C11H10Cl2O3
• Molecular Weight: 261.105
• DSSTox Substance ID: DTXSID50374208
• Wikidata: Q82162719
• Mol file: 172168-01-3.mol

Synonyms:ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate;172168-01-3;3-(3,5-Dichlorophenyl)-3-oxo-propionic acid ethyl ester;3-(3,5-dichloro-phenyl)-3-oxo-propionic acid ethyl ester;ethyl (3,5-dichlorobenzoyl)acetate;Ethyl3-(3,5-dichlorophenyl)-3-oxopropanoate;SCHEMBL2638020;DTXSID50374208;XYMHCPKOFUYEPU-UHFFFAOYSA-N;CS-M1358;XGA16801;MFCD03424831;AKOS015999911;SB34231;DS-17964;FT-0733998;W11712;A881892;J-010801

Chemical Property of Ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate

Chemical Property:

• PSA: 43.37000
• LogP: 3.12930
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 260.0006996
• Heavy Atom Count: 16
• Complexity: 258

Purity/Quality:

97% ^*data from raw suppliers

3-(3,5-DICHLORO-PHENYL)-3-OXO-PROPIONICACIDETHYLESTER 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC(=O)C1=CC(=CC(=C1)Cl)Cl

Technology Process of Ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate

There total 4 articles about Ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate 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: 92.0%

3,5-dichlorobenzoic acid ethyl ester (91085-56-2) + ethyl acetate (141-78-6) → ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate (172168-01-3)

Guidance literature:

With sodium hydride; In tetrahydrofuran; Inert atmosphere; Reflux;

DOI:10.1016/j.bmc.2016.04.053

Reference yield:

hydrogen ethyl malonate (1071-46-1) + 3,5-dichlorobenzoyl chloride (2905-62-6) → ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate (172168-01-3)

Guidance literature:

With n-butyllithium; In tetrahydrofuran;

Reference yield:

3,5-dichlorobenzoyl chloride (2905-62-6) → ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate (172168-01-3)

Guidance literature:

Multi-step reaction with 2 steps

1: Mg / ethanol; CCl₄; diethyl ether / 2 h / 60 °C

2: 1.) KOH, 2.) NH₄Cl, 30 percent NH₃ / 1.) EtOH, RT, 15 min, 2.) H₂O, 2.5 h

With potassium hydroxide; ammonium hydroxide; ammonium chloride; magnesium; In tetrachloromethane; diethyl ether; ethanol;

DOI:10.1016/0223-5234(96)88290-0

upstream raw materials:

3,5-dichlorobenzoyl chloride

hydrogen ethyl malonate

3,5-dichlorobenzoic acid ethyl ester

ethyl acetate

Downstream raw materials:

2-(3,5-Dichloro-benzoyl)-pentanedioic acid diethyl ester

2-(3,5-bis-trifluoromethyl-phenyl)-5-(3,5-dichloro-phenyl)-2,4-dihydro-pyrazol-3-one

5-(3,5-dichloro-phenyl)-2-phenyl-2,4-dihydro-pyrazol-3-one

5-(3,5-dichlorophenyl)-2-(2-naphthyl)-2,4-dihydro-3H-pyrazol-3-one

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 172168-01-3 3-(3,5-Dichlorophenyl)-3-oxo-propionic acid ethyl ester

Send

Send

Metric Ton KG G Pound L ML

Send

Send