Ethyl 5-(4-fluorophenyl)-2-methyl-3-furoate

Base Information

• Chemical Name: Ethyl 5-(4-fluorophenyl)-2-methyl-3-furoate
• CAS No.: 111787-83-8
• Molecular Formula: C14H13 F O3
• Molecular Weight: 248.254
• DSSTox Substance ID: DTXSID70383357
• Nikkaji Number: J3.538.127I
• Mol file: 111787-83-8.mol

Synonyms:111787-83-8;ethyl 5-(4-fluorophenyl)-2-methyl-3-furoate;ethyl 5-(4-fluorophenyl)-2-methylfuran-3-carboxylate;3-Furancarboxylic acid,5-(4-fluorophenyl)-2-methyl-, ethyl ester;5-(4-Fluoro-phenyl)-2-methyl-furan-3-carboxylic acid ethyl ester;DTXSID70383357;MFCD05664426;AKOS015911296;FT-0762521;J3.538.127I;2-Methyl-5-(4-fluorophenyl)furan-3-carboxylic acid ethyl ester

Chemical Property of Ethyl 5-(4-fluorophenyl)-2-methyl-3-furoate

Chemical Property:

• Vapor Pressure: 0.000181mmHg at 25°C
• Boiling Point: 329.1°Cat760mmHg
• Flash Point: 152.9°C
• PSA: 39.44000
• Density: 1.168g/cm³
• LogP: 3.57080
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 248.08487243
• Heavy Atom Count: 18
• Complexity: 287

Purity/Quality:

97% ^*data from raw suppliers

5-(4-Fluoro-phenyl)-2-methyl-furan-3-carboxylicacidethylester 95%+ ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=C(OC(=C1)C2=CC=C(C=C2)F)C

Technology Process of Ethyl 5-(4-fluorophenyl)-2-methyl-3-furoate

There total 10 articles about Ethyl 5-(4-fluorophenyl)-2-methyl-3-furoate 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: 84.0%

1-ethynyl-4-fluorobenzene (766-98-3) + ethyl acetoacetate (141-97-9) → ethyl 5-(4-fluorophenyl)-2-methylfuran-3-carboxylate (111787-83-8)

Guidance literature:

With potassium acetate; silver carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 12h; Inert atmosphere;

DOI:10.1021/ja301153k

Reference yield: 81.0%

N′-(1-(4-fluorophenyl)ethylidene)-4-methylbenzenesulfonohydrazide (75230-49-8) + ethyl acetoacetate (141-97-9) → ethyl 5-(4-fluorophenyl)-2-methylfuran-3-carboxylate (111787-83-8)

Guidance literature:

With Triallylamine; oxygen; zinc trifluoromethanesulfonate; copper(l) chloride; In N,N-dimethyl-formamide; toluene; at 120 ℃; for 10h; Reagent/catalyst; regioselective reaction; Catalytic behavior; Schlenk technique; Molecular sieve;

DOI:10.1021/acs.joc.6b00568

Reference yield: 80.0%

ethyl acetoacetate (141-97-9) + 1-(2,2-dibromovinyl)-4-fluorobenzene (159957-00-3) → ethyl 5-(4-fluorophenyl)-2-methylfuran-3-carboxylate (111787-83-8)

Guidance literature:

With potassium acetate; caesium carbonate; silver carbonate; In N,N-dimethyl-formamide; at 20 - 120 ℃; for 12h; Inert atmosphere;

DOI:10.1007/s10593-017-2100-2

upstream raw materials:

ethyl 2-acetyl-4-(4-fluorophenyl)-4-oxobutanoate

ethyl acetoacetate

2-bromo-4'-fluoroacetophenone

1-ethynyl-4-fluorobenzene

Downstream raw materials:

5-(4-fluorophenyl)-2-methyl-3-furancarboxylic acid

[5-(4-fluorophenyl)-2-methyl-furan-3-yl]methanol

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 111787-83-8 ETHYL 5-(4-FLUOROPHENYL)-2-METHYL-3-FUROATE

Send

Send

Metric Ton KG G Pound L ML

Send

Send