Bis(4-fluorophenyl)(phenyl)methanol

Base Information

• Chemical Name: Bis(4-fluorophenyl)(phenyl)methanol
• CAS No.: 379-55-5
• Molecular Formula: C19H14F2O
• Molecular Weight: 296.316
• Hs Code.: 2906299090
• European Community (EC) Number: 825-248-4
• DSSTox Substance ID: DTXSID00503263
• Nikkaji Number: J1.003.327F
• Wikidata: Q82356933
• Mol file: 379-55-5.mol

Synonyms:bis(4-fluorophenyl)(phenyl)methanol;379-55-5;bis(4-fluorophenyl)-phenylmethanol;Bis-(4-Fluoro-phenyl)-phenyl-methanol;Benzenemethanol,4-fluoro-a-(4-fluorophenyl)-a-phenyl-;SCHEMBL1443989;bis(4-fluorophenyl)phenylmethanol;DTXSID00503263;HRLJEADIACXJQZ-UHFFFAOYSA-N;CS-B0371;MFCD09743759;AKOS022173005;CS-14050;A25914;EN300-120131

Chemical Property of Bis(4-fluorophenyl)(phenyl)methanol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 100 °C
• Boiling Point: 410.605oC at 760 mmHg
• PKA: 12.60±0.29(Predicted)
• Flash Point: 202.127oC
• PSA: 20.23000
• Density: 1.241g/cm3
• LogP: 4.24900
• Storage Temp.: 2-8°C
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 296.10127139
• Heavy Atom Count: 22
• Complexity: 315

Purity/Quality:

97% ^*data from raw suppliers

Bis(4-fluorophenyl)(phenyl)methanol 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of Bis(4-fluorophenyl)(phenyl)methanol

There total 4 articles about Bis(4-fluorophenyl)(phenyl)methanol 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: 87.0%

fluorobenzene (462-06-6) + α,α,α-trifluorotoluene (98-08-8) → bis(4-fluorophenyl)phenylmethanol (379-55-5)

Guidance literature:

fluorobenzene; α,α,α-trifluorotoluene; With aluminum (III) chloride; at 20 ℃; Inert atmosphere;

With water; chemoselective reaction;

DOI:10.1246/cl.2010.124

Reference yield:

4,4'-Difluorobenzophenone (345-92-6) + phenylmagnesium bromide (100-58-3) → bis(4-fluorophenyl)phenylmethanol (379-55-5)

Guidance literature:

With hydrogenchloride; In tert-butylmethyl ether;

Reference yield:

benzoic acid methyl ester (93-58-3,5705-52-2,80226-58-0) + 4-flourophenylmagnesium bromide (352-13-6) → bis(4-fluorophenyl)phenylmethanol (379-55-5)

Guidance literature:

With diethyl ether;

DOI:10.1021/ja01234a023 DOI:10.1021/jo01220a011 DOI:10.1557/mrs2001.65

upstream raw materials:

benzoic acid methyl ester

4-flourophenylmagnesium bromide

4,4'-Difluorobenzophenone

phenylmagnesium bromide

Downstream raw materials:

bis-(4-fluoro-phenyl)-phenyl-methane

bis(4-fluorophenyl)phenylchloromethane

4-fluorophenyl-4-hydroxyphenyl(phenyl)methane

CDD₃₅₄₃

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