Benzoic acid, 4-fluoro-, phenylmethyl ester

Base Information

• Chemical Name: Benzoic acid, 4-fluoro-, phenylmethyl ester
• CAS No.: 59986-44-6
• Molecular Formula: C14H11FO2
• Molecular Weight: 230.239
• Mol file: 59986-44-6.mol

Synonyms:benzyl-4-fluorobenzoate;Benzoic acid,4-fluoro-,phenylmethyl ester;benzyl p-fluorobenzoate;4-Fluorobenzoic acid,benzyl ester;

Chemical Property of Benzoic acid, 4-fluoro-, phenylmethyl ester

Chemical Property:

• Boiling Point: 328.5±17.0 °C(Predicted)
• PSA: 26.30000
• Density: 1?+-.0.06 g/cm3(Predicted)
• LogP: 3.18270

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzoic acid, 4-fluoro-, phenylmethyl ester

There total 18 articles about Benzoic acid, 4-fluoro-, phenylmethyl ester 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: 97.0%

4-Fluorobenzoic acid (456-22-4) + toluene (108-88-3,15644-74-3,16713-13-6) → benzyl 4-fluorobenzoate (59986-44-6)

Guidance literature:

With di-tert-butyl peroxide; C₁₁H₂₃N₂⁽¹⁺⁾*Br₄Fe^(1-); at 110 ℃; for 24h;

DOI:10.1021/acs.orglett.7b00148

Reference yield: 94.0%

4-Fluorobenzoic acid (456-22-4) + benzyl alcohol (100-51-6,185532-71-2) → benzyl 4-fluorobenzoate (59986-44-6)

Guidance literature:

With dmap; dicyclohexyl-carbodiimide; In dichloromethane; at 20 ℃; for 18h;

DOI:10.1021/jm049274d

Reference yield: 93.0%

4-fluorobenzaldehyde (459-57-4) + benzyl alcohol (100-51-6,185532-71-2) → benzyl 4-fluorobenzoate (59986-44-6)

Guidance literature:

With 3-mesityl-4-methylthiazol-3-ium bis((trifluoromethyl)sulfonyl)imide; dimethyl sulfoxide; 1,8-diazabicyclo[5.4.0]undec-7-ene; In tetrahydrofuran; Electrochemical reaction; Inert atmosphere; Flow reactor;

DOI:10.1021/acs.orglett.5b01459

upstream raw materials:

4-fluorobenzoyl chloride

benzyl alcohol

4-Fluorobenzoic acid

benzyl bromide

Downstream raw materials:

ethyl N-(4-benzyloxycarbonylphenoxy)acetimidate

1-(4-carboxy-phenyl)-piperidine-4-carboxylic acid ethyl ester

4-Fluorobenzoic acid

1-methyl-3-(phenylmethyl)-benzene

Refernces

• 1、 Lai, Ming,Qi, Xinxin,Wu, Xiao-Feng. "Palladium-Catalyzed Carbonylative Synthesis of Benzyl Benzoates Employing Benzyl Formates as Both CO Surrogates and Benzyl Alcohol Sources". supporting information. p. 3776 - 3778. Retrieved 2019/06/24.
• 2、 -. "COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR". Paragraph 0395. . Retrieved 2018/04/20.