2-Chloro-4'-fluorobenzophenone

Base Information

• Chemical Name: 2-Chloro-4'-fluorobenzophenone
• CAS No.: 1806-23-1
• Molecular Formula: C13H8ClFO
• Molecular Weight: 234.657
• Hs Code.: 2914700090
• European Community (EC) Number: 217-300-4
• NSC Number: 141026
• UNII: SN5N5MA34F
• DSSTox Substance ID: DTXSID2061983
• Nikkaji Number: J43.117F
• Wikidata: Q72516819
• Mol file: 1806-23-1.mol

Synonyms:2-Chloro-4'-fluorobenzophenone;1806-23-1;(2-Chlorophenyl)(4-fluorophenyl)methanone;(2-chlorophenyl)-(4-fluorophenyl)methanone;Methanone, (2-chlorophenyl)(4-fluorophenyl)-;C13H8ClFO;2-Chloro-4/'-fluorobenzophenone;SN5N5MA34F;EINECS 217-300-4;MFCD00000559;NSC 141026;NSC-141026;NSC141026;UNII-SN5N5MA34F;MAGALDRATE(200MG);SCHEMBL333687;DTXSID2061983;DODIKYQYCCFWRZ-UHFFFAOYSA-;o-chlorophenyl p-fluorophenyl ketone;AKOS003854653;2-CHLORO-4'-FLUORO-BENZOPHENONE;AS-10886;(2-Chlorophenyl)(4-fluorophenyl)methanone #;C1860;CS-0156715;FT-0611762;EN300-43459;S10436;A812552;W-107810;Z385412744

Chemical Property of 2-Chloro-4'-fluorobenzophenone

Chemical Property:

• Appearance/Colour: white crystal
• Melting Point: 60-62 °C
• Boiling Point: 337.3 °C at 760 mmHg
• Flash Point: 157.8 °C
• PSA: 17.07000
• Density: 1.277 g/cm³
• LogP: 3.71010
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 234.0247707
• Heavy Atom Count: 16
• Complexity: 248

Purity/Quality:

99% ^*data from raw suppliers

2-Chloro-4''-fluorobenzophenone ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 21
• Safety Statements: 28

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)F)Cl

Technology Process of 2-Chloro-4'-fluorobenzophenone

There total 7 articles about 2-Chloro-4'-fluorobenzophenone 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: 80.0%

dimethylsulfone (67-71-0) + 2,4'-dichlorobenzophenone (85-29-0) → o-chlorophenyl p-fluorophenyl ketone (1806-23-1)

Guidance literature:

With potassium fluoride; In water; isopropyl alcohol; benzene;

Reference yield: 64.0%

fluorobenzene (462-06-6) + o-chlorobenzoyl chloride (609-65-4) → o-chlorophenyl p-fluorophenyl ketone (1806-23-1)

Guidance literature:

With copper(II) ferrite; In neat (no solvent); at 80 ℃; for 24h;

DOI:10.1016/j.tetlet.2013.01.081

Reference yield:

→ o-chlorophenyl p-fluorophenyl ketone (1806-23-1)

Guidance literature:

Nach Friedel-Crafts;

upstream raw materials:

fluorobenzene

o-chlorobenzoyl chloride

dimethylsulfone

2,4'-dichlorobenzophenone

Downstream raw materials:

2-chloro-4'-(imidazol-1-yl)benzophenone

(2-chlorophenyl)(4-fluorophenyl)methanol

C₁₃H₉BrClF

(2-chlorophenyl)-<4-(imidazol-1-yl)phenyl>phenylmethyl alcohol

Refernces

• 1、 Huang, Zheng,Liu, Guixia,Qian, Lu,Tang, Xixia,Wang, Yulei. "Asymmetric Transfer Hydrogenation of Diaryl Ketones with Ethanol Catalyzed by Chiral NCP Pincer Iridium Complexes". supporting information. . Retrieved 2022/02/23.
• 2、 Parella, Ramarao,Naveen,Kumar, Amit,Babu, Srinivasarao Arulananda. "Catalytic Friedel-Crafts acylation: Magnetic nanopowder CuFe 2O4 as an efficient and magnetically separable catalyst". . p. 1738 - 1742. Retrieved 2013/03/28.