(4-Fluoro-3-phenoxyphenyl)methanol

Base Information

• Chemical Name: (4-Fluoro-3-phenoxyphenyl)methanol
• CAS No.: 68359-53-5
• Molecular Formula: C13H11FO2
• Molecular Weight: 218.228
• Hs Code.: 2906290090
• DSSTox Substance ID: DTXSID20512099
• Wikidata: Q82371198
• Mol file: 68359-53-5.mol

Synonyms:(4-fluoro-3-phenoxyphenyl)methanol;68359-53-5;4-fluoro-3-phenoxybenzyl alcohol;Benzenemethanol, 4-fluoro-3-phenoxy-;P-FLUORO-M-PHENOXYBENZYL ALCOHOL;3-(Phenoxy)-4-fluorobenzyl alcohol;SCHEMBL9539557;4-fluoro3-phenoxybenzyl alcohol;4-fluoro-3-phenoxyphenylmethanol;DTXSID20512099;UFXDRIJUGWOQTP-UHFFFAOYSA-N;3-phenoxy-4-fluoro-benzyl alcohol;(4-Fluoro-3-phenoxy-phenyl)methanol;MFCD06202979;(3-phenoxy-4-fluoro-phenyl)-methanol;AKOS015961940;(4-fluoro3-phenoxyphenyl)methyl alcohol;(4-fluoro-3-phenoxyphenyl)methyl alcohol;AC-15258

Chemical Property of (4-Fluoro-3-phenoxyphenyl)methanol

Chemical Property:

• Vapor Pressure: 0.000158mmHg at 25°C
• Boiling Point: 317.8oC at 760 mmHg
• PKA: 13.94±0.10(Predicted)
• Flash Point: 149.8oC
• PSA: 29.46000
• Density: 1.225g/cm3
• LogP: 3.11030
• Storage Temp.: 2-8°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 218.07430775
• Heavy Atom Count: 16
• Complexity: 204

Purity/Quality:

99% ^*data from raw suppliers

(4-Fluoro-3-phenoxy-phenyl)-methanol 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OC2=C(C=CC(=C2)CO)F

Technology Process of (4-Fluoro-3-phenoxyphenyl)methanol

There total 2 articles about (4-Fluoro-3-phenoxyphenyl)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: 98.0%

4-fluoro-3-phenoxybenzaldehyde (68359-57-9) → 4-fluoro-3-phenoxyphenylmethanol (68359-53-5)

Guidance literature:

With formic acid; C₂₀H₂₉ClIrN₄⁽¹⁺⁾*Cl^(1-); In ethanol; water; at 80 ℃; for 0.25h; chemoselective reaction;

DOI:10.1039/c7gc01289f

Reference yield: 98.0%

→ 4-fluoro-3-phenoxyphenylmethanol (68359-53-5)

Guidance literature:

With formic acid; C₂₀H₂₉ClIrN₄⁽¹⁺⁾*Cl^(1-); In water; at 80 ℃; for 0.25h;

Reference yield: 95.0%

4-fluoro-3-phenoxyphenylmethanol (68359-53-5) + 2,2-dimethyl-3R-(2',2'-dibromovinyl)-cyclopropane-1R-carboxylic acid (53179-78-5,59952-39-5,61914-48-5,63538-10-3,63597-73-9,63949-77-9,72691-16-8,72691-18-0,74560-76-2) → 4-fluoro-3-phenoxybenzyl (1R,3R)-3-(2,2-dibromoethenyl)-2,2-dimethylcyclopropanecarboxylate

Guidance literature:

With pyridine; In toluene; at 0 - 20 ℃; for 4h; Solvent; Temperature;

upstream raw materials:

4-fluoro-3-phenoxybenzaldehyde

Downstream raw materials:

(4-fluoro-3-phenoxyphenyl)methyl chloride

3-Phenoxy-4-fluorobenzyl 2-(3-methylphenyl)-2-methylpropyl ether

3-phenoxy-4-fluorobenzyl 2-(4-chlorophenyl)-2-methylpropyl ether

2,2-dimethyl-3-(2-chloro-2-(4-methoxyphenyl)-vinyl)-cyclopropanecarboxylic acid (4-fluoro-3-phenoxy-benzyl)-ester