(4-Phenylphenyl) benzoate

Base Information

• Chemical Name: (4-Phenylphenyl) benzoate
• CAS No.: 2170-13-0
• Molecular Formula: C19H14O2
• Molecular Weight: 274.319
• European Community (EC) Number: 683-536-3
• NSC Number: 28435
• DSSTox Substance ID: DTXSID40282848
• Nikkaji Number: J964.080K
• Wikidata: Q72443631
• Mol file: 2170-13-0.mol

Synonyms:(4-phenylphenyl) benzoate;2170-13-0;4-Biphenylyl benzoate;Benzoic Acid 4-Biphenyl Ester;4-Biphenyl Benzoate;BENZOIC ACID BIPHENYL-4-YL ESTER;NSC28435;4-biphenylylbenzoate;4-Benzoyloxybiphenyl;CBDivE_002849;SCHEMBL2638440;Benzoic acid, 4-biphenyl ester;Benzoic Acid 4-Biphenyl Ester;DTXSID40282848;MFCD00223541;NSC 28435;NSC-28435;AKOS002954034;CS-W014280;[1,1'-BIPHENYL]-4-YL BENZOATE;B1866;FT-0654771;D81799;A815619

Chemical Property of (4-Phenylphenyl) benzoate

Chemical Property:

• Vapor Pressure: 1.58E-07mmHg at 25°C
• Melting Point: 151 °C
• Refractive Index: 1.609
• Boiling Point: 427.9 °C at 760 mmHg
• Flash Point: 180.9 °C
• PSA: 26.30000
• Density: 1.151 g/cm³
• LogP: 4.57280
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: very faint turbidity in hot Toluene
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 274.099379685
• Heavy Atom Count: 21
• Complexity: 319

Purity/Quality:

98% ^*data from raw suppliers

4-Biphenyl Benzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3

Technology Process of (4-Phenylphenyl) benzoate

There total 24 articles about (4-Phenylphenyl) benzoate 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: 99.0%

4-Phenylphenol (92-69-3) + benzoyl chloride (98-88-4) → biphenyl 4-yl benzoate (2170-13-0)

Guidance literature:

With pyridine; for 0.5h; Heating;

DOI:10.1002/jhet.5570380102

Reference yield: 98.0%

iodobenzene (591-50-4) + carbon monoxide (201230-82-2) + 4-Phenylphenol (92-69-3) → biphenyl 4-yl benzoate (2170-13-0)

Guidance literature:

With dicarbonyl(acetylacotonato)rhodium(I); triethylamine; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In toluene; at 120 ℃; for 48h; Inert atmosphere; Autoclave; Schlenk technique;

DOI:10.1016/j.mcat.2018.07.021

Reference yield: 96.0%

benzoyl fluoride (455-32-3) + 4-Phenylphenol (92-69-3) → biphenyl 4-yl benzoate (2170-13-0)

Guidance literature:

With hydridotetakis(triphenylphosphine)rhodium(I); 1,2-bis-(diphenylphosphino)ethane; In chlorobenzene; for 3h; Inert atmosphere; Reflux;

DOI:10.1016/j.tet.2011.07.031

upstream raw materials:

4-Phenylphenol

Ethyl benzoyl carbonate

benzoyl chloride

chlorocarbonic acid biphenyl-4-yl ester

Downstream raw materials:

4-(benzoyloxy)-4'-nitrobiphenyl

4-benzoyloxy-4'-bromobiphenyl

4-(4'-hydroxyphenyl)benzophenone

4-Phenylphenol

Refernces

• 1、 Liu, Ming,Zheng, Xinguo,Gong, Shiming,Liu, Lulu,Sun, Zhen,Shao, Leishan,Wang, Yinghan. "Effect of the functional diamine structure on the properties of a polyimide liquid crystal alignment film". . p. 25348 - 25356. Retrieved 2015.
• 2、 Day, Craig,Jia, Xin,Wei, Lanfeng,Xu, Liang,Zu, Weisai. "Dual aminoquinolate diarylboron and nickel catalysed metallaphotoredox platform for carbon-oxygen bond construction". supporting information. p. 8273 - 8276. Retrieved 2020/08/17.
• 3、 Ding, Hao,Qi, Wan-Ying,Zhen, Jing-Song,Ding, Qiuping,Luo, Yong. "Visible light-mediated transition metal-free esterification of amides with boronic acids". supporting information. . Retrieved 2020/10/02.