Chlorodiphenylmethane

Base Information

• Chemical Name: Chlorodiphenylmethane
• CAS No.: 90-99-3
• Molecular Formula: C13H11Cl
• Molecular Weight: 202.683
• Hs Code.: 29036990
• European Community (EC) Number: 202-031-7
• NSC Number: 76584
• UNII: CN9N9AYV4B
• DSSTox Substance ID: DTXSID10861684
• Nikkaji Number: J4.331A
• Wikidata: Q27275553
• Mol file: 90-99-3.mol

Synonyms:CHLORODIPHENYLMETHANE;90-99-3;Benzhydryl chloride;(Chloromethylene)dibenzene;Diphenylchloromethane;Benzene, 1,1'-(chloromethylene)bis-;Diphenylmethyl chloride;Methane, chlorodiphenyl-;[Chloro(phenyl)methyl]benzene;Chloro(diphenyl)methane;1,1'-(Chloromethylene)bisbenzene;benzhydrylchloride;alpha-Chloroditan;UNII-CN9N9AYV4B;CN9N9AYV4B;HSDB 2804;EINECS 202-031-7;MFCD00000855;NSC 76584;NSC-76584;AI3-11230;benzhydryl-chloride;diphenylmethylchloride;chlor(diphenyl)methan;diphenymethyl chloride;diphenyl methylchloride;a-Chlorodiphenylmethane;chloro-diphenyl-methane;1,1-Diphenylchloromethane;alpha-Chlorodiphenylmethane;.ALPHA.-CHLORODITAN;Chlorodiphenylmethane, 98%;1,1-Diphenylmethyl Chloride;SCHEMBL151375;1-chloro-1,1-diphenylmethane;1-chloro-1, 1-diphenylmethane;[Chloro(phenyl)methyl]benzene #;DTXSID10861684;Benzene,1'-(chloromethylene)bis-;CHLORODIPHENYLMETHANE [HSDB];NSC76584;.ALPHA.-CHLORODIPHENYLMETHANE;1,1'-(Chloromethylene)bis(benzene);AKOS000120659;CS-W015490;N-(4-FLUOROPHENYL)ANTHRANILICACID;AS-11942;AM20041357;B1078;FT-0622661;EN300-20926;D70178;Q-200687;Q27275553;F0001-2208

Chemical Property of Chlorodiphenylmethane

Chemical Property:

• Appearance/Colour: Clear colorless to yellow liquid
• Vapor Pressure: 0.000806mmHg at 25°C
• Melting Point: 15-17 ºC(lit.)
• Refractive Index: n20/D 1.595(lit.)
• Boiling Point: 315.5 ºC at 760 mmHg
• Flash Point: 127 ºC
• PSA: 0.00000
• Density: 1.119 g/cm³
• LogP: 4.01480
• Storage Temp.: Store below +30°C.
• Solubility.: Chloroform (Soluble), Methanol (Sparingly)
• Water Solubility.: slightly soluble
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 202.0549280
• Heavy Atom Count: 14
• Complexity: 137

Purity/Quality:

99% ^*data from raw suppliers

Chlorodiphenylmethane ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,C
• Hazard Codes: Xi,C
• Statements: 36/38-36/37/38-36-34
• Safety Statements: 26-36-24/25-45-36/37/39-27

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Halogenated Polyaromatics
• Canonical SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)Cl
• Uses: Chlorodiphenylmethane was used as initiator during the controlled radical polymerization of styrene catalyzed by ionic iron complex. It was also used as the starting reagent in the synthesis of trimethylhydroquinone derivatives.

Technology Process of Chlorodiphenylmethane

There total 105 articles about Chlorodiphenylmethane 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%

1,1-Diphenylmethanol (91-01-0) → diphenylchloromethane (90-99-3)

Guidance literature:

With 1,2,3-Benzotriazole; thionyl chloride; In dichloromethane; at 20 ℃;

DOI:10.1055/s-1999-2943

Reference yield: 95.0%

N-(diphenylmethyl)pyridin-2-amine (96354-74-4) → 2-aminopyridine (504-29-0) + diphenylchloromethane (90-99-3)

Guidance literature:

With hydrogenchloride; In water; at 20 ℃; for 16h; Sealed tube;

DOI:10.1002/anie.201810947

Reference yield: 93.0%

benzophenone hydrazone (5350-57-2) → diphenylchloromethane (90-99-3)

Guidance literature:

With oxalyl dichloride; dimethyl sulfoxide; triethylamine; In dichloromethane; at -78 - 20 ℃;

DOI:10.1016/j.tetlet.2006.08.120

upstream raw materials:

1,1-Diphenylmethanol

Dichloromethyl methyl ether

butyl magnesium bromide

Diphenylmethane

Downstream raw materials:

3-benzhydryloxy-1-methyl-piperidine

diphenylpyraline

N-benzhydryl pyridinium chloride

1-benzhydryl-4-isopropyl-piperazine

Refernces

• 1、 Xiang, Ming,Zhou, Chao,Yang, Xiu-Long,Chen, Bin,Tung, Chen-Ho,Wu, Li-Zhu. "Visible Light-Catalyzed Benzylic C-H Bond Chlorination by a Combination of Organic Dye (Acr+-Mes) and N-Chlorosuccinimide". . p. 9080 - 9087. Retrieved 2020/08/14.
• 2、 Patil, Mahadev,Noonikara Poyil, Anurag,Joshi, Shrinivas D.,Patil, Shivaputra A.,Patil, Siddappa A.,Bugarin, Alejandro. "Design, synthesis, and molecular docking study of new piperazine derivative as potential antimicrobial agents". supporting information. . Retrieved 2019/09/06.