Methyl 5-(4-methoxyphenyl)-5-oxopentanoate

Base Information

• Chemical Name: Methyl 5-(4-methoxyphenyl)-5-oxopentanoate
• CAS No.: 1847-68-3
• Molecular Formula: C13H16O4
• Molecular Weight: 236.268
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID60390939
• Nikkaji Number: J1.911.635B
• Mol file: 1847-68-3.mol

Synonyms:methyl 5-(4-methoxyphenyl)-5-oxopentanoate;1847-68-3;Methyl5-(4-methoxyphenyl)-5-oxopentanoate;SCHEMBL9541227;DTXSID60390939;5-(4-METHOXY-PHENYL)-5-OXO-PENTANOIC ACID METHYL ESTER;BAA84768;MFCD00229176;AKOS005073894;SS-3047;Methyl 5-(4-methoxyphenyl)-5-oxovalerate;CS-0336699;FT-0681689;4-(4-Methoxybenzoyl)butyric acid methyl ester;A880758;J-522404

Chemical Property of Methyl 5-(4-methoxyphenyl)-5-oxopentanoate

Chemical Property:

• PSA: 52.60000
• LogP: 2.22120
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 236.10485899
• Heavy Atom Count: 17
• Complexity: 254

Purity/Quality:

99%, ^*data from raw suppliers

Methyl5-(4-methoxyphenyl)-5-oxopentanoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C(=O)CCCC(=O)OC

Technology Process of Methyl 5-(4-methoxyphenyl)-5-oxopentanoate

There total 13 articles about Methyl 5-(4-methoxyphenyl)-5-oxopentanoate 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: 95.5%

methyl 4-(chlorocarbonyl)butyrate (1501-26-4) + 4-methoxyphenyl magnesium bromide (13139-86-1) → 5-(4-methoxy-phenyl)-5-oxo-pentanoic acid methyl ester (1847-68-3)

Guidance literature:

With copper(I) bromide; lithium bromide; In tetrahydrofuran; at 20 ℃; for 0.5h; Inert atmosphere;

DOI:10.1016/j.tet.2010.10.068

Reference yield:

methanol (67-56-1) + carbon monoxide (201230-82-2) + 1-(4-methoxyphenyl)cyclobutan-1-ol (164171-80-6) → 5-(4-methoxy-phenyl)-5-oxo-pentanoic acid methyl ester (1847-68-3)

Guidance literature:

With [2,2]bipyridinyl; [bis(acetoxy)iodo]benzene; manganese(III) triacetate dihydrate; at 100 ℃; for 20h; under 45004.5 Torr; chemoselective reaction; Autoclave;

DOI:10.1016/j.tetlet.2019.02.028

Reference yield:

methyl 4-(chlorocarbonyl)butyrate (1501-26-4) + methoxybenzene (100-66-3) → 5-(4-methoxy-phenyl)-5-oxo-pentanoic acid methyl ester (1847-68-3)

Guidance literature:

With aluminium trichloride;

DOI:10.1021/ja01565a065

upstream raw materials:

5-(4-methoxyphenyl)-5-oxopentanoic acid

methyl 4-(chlorocarbonyl)butyrate

methoxybenzene

4-(Methoxycarbonylamino)buttersaeure-methylester

Downstream raw materials:

[5-methoxycarbonyl-2-(4-methoxy-phenyl)-6-oxo-cyclohex-1-enyl]-acetic acid

3-(4-methoxy-phenyl)-hexane-1,2,6-tricarboxylic acid trimethyl ester

5-(4-methoxyphenyl)-5-oxopentanoic acid

(±)-2-(4-methoxyphenyl)cyclopentan-1-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 1847-68-3 Methyl 5-(4-methoxyphenyl)-5-oxopentanoate

Send

Send

Metric Ton KG G Pound L ML

Send

Send