2-(4-Nitrophenyl)-1-phenylethanone

Base Information

• Chemical Name: 2-(4-Nitrophenyl)-1-phenylethanone
• CAS No.: 3769-82-2
• Molecular Formula: C14H11 N O3
• Molecular Weight: 241.246
• NSC Number: 144625,34502
• DSSTox Substance ID: DTXSID90283961
• Nikkaji Number: J1.687.405A
• Wikidata: Q82018727
• ChEMBL ID: CHEMBL1903264
• Mol file: 3769-82-2.mol

Synonyms:2-(4-nitrophenyl)-1-phenylethanone;3769-82-2;2-(4-nitrophenyl)-1-phenylethan-1-one;Ethanone, 2-(4-nitrophenyl)-1-phenyl-;MLS002607884;NSC34502;SCHEMBL4319309;2-(4-nitrophenyl)-acetophenone;CHEMBL1903264;DTXSID90283961;KIHOOGDHEALLCJ-UHFFFAOYSA-N;HMS3078K12;BBL028590;MFCD00451465;NSC-34502;NSC144625;STL373483;AKOS010285307;NSC-144625;SMR001526646;VS-08858;CS-0046917;W16113

Chemical Property of 2-(4-Nitrophenyl)-1-phenylethanone

Chemical Property:

• Vapor Pressure: 4.9E-07mmHg at 25°C
• Boiling Point: 413.2°C at 760 mmHg
• Flash Point: 200.2°C
• Density: 1.246g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 241.07389321
• Heavy Atom Count: 18
• Complexity: 297

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Technology Process of 2-(4-Nitrophenyl)-1-phenylethanone

There total 45 articles about 2-(4-Nitrophenyl)-1-phenylethanone 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-Nitrophenylacetonitrile (555-21-5,34512-13-5,174848-08-9) + phenylboronic acid (98-80-6) → 2-(4-nitrophenyl)-1-phenylethanone (3769-82-2)

Guidance literature:

With [2,2]bipyridinyl; palladium diacetate; trifluoroacetic acid; In tetrahydrofuran; water; at 80 ℃; for 36h; Schlenk technique; Inert atmosphere;

DOI:10.1055/s-0033-1338909

Reference yield: 91.0%

1-acetoxy-1-phenylethene (2206-94-2) + 4-nitro-aniline (100-01-6,104810-17-5) → 2-(4-nitrophenyl)-1-phenylethanone (3769-82-2)

Guidance literature:

With tert.-butylnitrite; eosin bluish; In water; at 20 ℃; for 2h; Sealed tube; Irradiation; Micellar solution; Green chemistry;

DOI:10.1039/c8cy01221k

Reference yield: 91.0%

Benzoesaeure-<2-(4-nitrophenyl)-1-phenylethenylester> (90013-78-8) → 2-(4-nitrophenyl)-1-phenylethanone (3769-82-2)

Guidance literature:

With potassium hydroxide; In methanol; for 0.0833333h; Ambient temperature;

upstream raw materials:

phenyl benzyl ketone

4-nitrophenylacetyl chloride

benzene

diphenyl {[(4-nitrophenyl)amino](phenyl)methyl}phosphonate

Downstream raw materials:

2-(4-nitro-phenyl)-1-phenyl-butan-1-one

4-Phenyl-5-(4-nitro-phenyl)-2,3-dimethyl-thiazolium

2-(4-aminophenyl)-1-phenylethan-1-one

4-nitrobenzil

Refernces

• 1、 Chen, Ruijia,Fu, Wen,Li, Zhong,Qiao, Zhi,Shao, Xusheng,Xu, Zhiping,Zhang, Yongchao. "Azobenzene-Semicarbazone Enables Optical Control of Insect Sodium Channels and Behavior". . p. 15554 - 15561. Retrieved 2021/12/27.
• 2、 Wang, Jingjing,Xue, Linshuang,Hong, Mei,Ni, Bangqing,Niu, Tengfei. "Heterogeneous visible-light-induced Meerwein hydration reaction of alkenes in water using mpg-C3N4 as a recyclable photocatalyst". . p. 411 - 416. Retrieved 2020/02/13.