5-(4-Fluorophenyl)furan-2-carbonyl chloride

Base Information

• Chemical Name: 5-(4-Fluorophenyl)furan-2-carbonyl chloride
• CAS No.: 380889-69-0
• Molecular Formula: C11H6 Cl F O2
• Molecular Weight: 224.619
• Hs Code.: 2932190090
• DSSTox Substance ID: DTXSID80378153
• Wikidata: Q82167669
• Mol file: 380889-69-0.mol

Synonyms:380889-69-0;5-(4-fluorophenyl)furan-2-carbonyl chloride;5-(4-Fluorophenyl)-2-furoyl chloride;DTXSID80378153;STK163232;5-(4-Fluorophenyl)-2-furoylchloride;AKOS000289088;BB 0245441;FT-0747823;5-(4-Fluoro-phenyl)-furan-2-carbonyl chloride;A873925;5-(4-Fluorophenyl)-2-furoyl chloride, AldrichCPR

Chemical Property of 5-(4-Fluorophenyl)furan-2-carbonyl chloride

Chemical Property:

• Vapor Pressure: 0.00022mmHg at 25°C
• Refractive Index: 1.547
• Boiling Point: 326.1°C at 760 mmHg
• Flash Point: 151°C
• PSA: 30.21000
• Density: 1.335g/cm³
• LogP: 3.46470
• Sensitive.: Moisture Sensitive
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 224.0040353
• Heavy Atom Count: 15
• Complexity: 239

Purity/Quality:

99% ^*data from raw suppliers

5-(4-Fluorophenyl)furan-2-carbonylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CC=C(O2)C(=O)Cl)F
• Uses: 5-(4-Fluorophenyl)furan-2-carbonyl Chloride can beused as potential PDE4 inhibitors.

Technology Process of 5-(4-Fluorophenyl)furan-2-carbonyl chloride

There total 6 articles about 5-(4-Fluorophenyl)furan-2-carbonyl chloride 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: 89.0%

5-(4-fluorophenyl)furan-2-carboxylic acid (73269-32-6) → C11H6ClFO2 (380889-69-0)

Guidance literature:

With thionyl chloride; In benzene; Reflux;

DOI:10.1134/S1070428009040125

Reference yield:

2-furanoic acid (88-14-2) → C11H6ClFO2 (380889-69-0)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogenchloride; sodium nitrite

2: thionyl chloride / benzene / 3 h / Reflux

With hydrogenchloride; thionyl chloride; sodium nitrite; In benzene; 1: Meerwein arylation;

DOI:10.1111/j.1747-0285.2011.01266.x

Reference yield:

4-fluoroaniline (371-40-4) → C11H6ClFO2 (380889-69-0)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogenchloride; sodium nitrite

2: thionyl chloride / benzene / 3 h / Reflux

With hydrogenchloride; thionyl chloride; sodium nitrite; In benzene; 1: Meerwein arylation;

DOI:10.1111/j.1747-0285.2011.01266.x

upstream raw materials:

5-(4-fluorophenyl)furan-2-carboxylic acid

2-furanoic acid

4-fluoroaniline

4-fluoroboronic acid

Downstream raw materials:

C₁₅H₁₇FN₂O₂

C₁₅H₁₇FN₂O₂

N-5-(4'-fluorophenyl)-2-furoyl-1H-pyrazole

N-5-(4'-fluorophenyl)-2-furoyl-1H-1,2,4-triazole

Refernces

• 1、 -. "2-furoylamide compound and preparation and application thereof". Paragraph 0036; 0041-0043. . Retrieved 2020/08/22.
• 2、 Lin, Yinuo,Ahmed, Wasim,He, Min,Xiang, Xuwen,Tang, Riyuan,Cui, Zi-Ning. "Synthesis and bioactivity of phenyl substituted furan and oxazole carboxylic acid derivatives as potential PDE4 inhibitors". . . Retrieved 2020/10/02.