Benzenepropanoyl chloride, 4-fluoro-

Base Information

• Chemical Name: Benzenepropanoyl chloride, 4-fluoro-
• CAS No.: 772-70-3
• Molecular Formula: C₉H₈ClFO
• Molecular Weight: 186.613
• Mol file: 772-70-3.mol

Synonyms:3-(4-fluorophenyl)propanoyl chloride

Chemical Property of Benzenepropanoyl chloride, 4-fluoro-

Chemical Property:

• Boiling Point: 249.9±23.0 °C(Predicted)
• Density: 1.231±0.06 g/cm3(Predicted)

Purity/Quality:

99% ^*data from raw suppliers

3-(4-Fluorophenyl)propionylchloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzenepropanoyl chloride, 4-fluoro-

There total 6 articles about Benzenepropanoyl chloride, 4-fluoro- 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: 100.0%

3-(4-fluorophenyl)propanoic acid (459-31-4) → 3-(4-fluorophenyl)propanoyl chloride (772-70-3)

Guidance literature:

With oxalyl dichloride; N,N-dimethyl-formamide; In benzene; at 20 ℃; for 18h;

Reference yield:

4-fluorocinnamic acid (459-32-5,14290-66-5,14290-86-9) → 3-(4-fluorophenyl)propanoyl chloride (772-70-3)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂ / Pd-C / acetic acid

2: SOCl₂ / benzene / Heating

With thionyl chloride; hydrogen; palladium on activated charcoal; In acetic acid; benzene;

DOI:10.1021/jo01052a055

Reference yield:

4-fluorobenzaldehyde (459-57-4) → 3-(4-fluorophenyl)propanoyl chloride (772-70-3)

Guidance literature:

Multi-step reaction with 3 steps

1: NaOAc / 12 h / Heating

2: Na-Hg, aq. NaOH / 12 h / 60 °C

3: SOCl₂ / Heating

With sodium hydroxide; thionyl chloride; sodium amalgam; sodium acetate;

upstream raw materials:

3-(4-fluorophenyl)propanoic acid

4-fluorocinnamic acid

4-fluorobenzaldehyde

ethyl 3-(4-fluorophenyl)propanoate

Downstream raw materials:

6-fluoroindan-1-one

N-(2-benzoyl-4-nitrophenyl)-3-(4-fluorophenyl)propionic acid amide

(5R,6R)-5-Benzyl-1-[3-(4-fluoro-phenyl)-propionyl]-6-(2-trimethylsilanyl-ethoxymethoxy)-[1,2,4]triazepan-3-one

methyl [4-fluoro-2-(3-fluorobenzyl)phenyl] acetate

Refernces

• 1、 Ni, Shengyang,Padial, Natalia M.,Kingston, Cian,Vantourout, Julien C.,Schmitt, Daniel C.,Edwards, Jacob T.,Kruszyk, Monika M.,Merchant, Rohan R.,Mykhailiuk, Pavel K.,Sanchez, Brittany B.,Yang, Shouliang,Perry, Matthew A.,Gallego, Gary M.,Mousseau, James J.,Collins, Michael R.,Cherney, Robert J.,Lebed, Pavlo S.,Chen, Jason S.,Qin, Tian,Baran, Phil S.. "A Radical Approach to Anionic Chemistry: Synthesis of Ketones, Alcohols, and Amines". supporting information. p. 6726 - 6739. Retrieved 2019/05/06.
• 2、 Li, Shangda,Wang, Hang,Weng, Yunxiang,Li, Gang. "Carboxy Group as a Remote and Selective Chelating Group for C?H Activation of Arenes". supporting information. p. 18502 - 18507. Retrieved 2019/11/14.