(2-Fluoro-4-methoxyphenyl)methanol

Base Information

• Chemical Name: (2-Fluoro-4-methoxyphenyl)methanol
• CAS No.: 405-09-4
• Molecular Formula: C8H9FO2
• Molecular Weight: 156.157
• Hs Code.: 2909499000
• European Community (EC) Number: 609-840-8
• DSSTox Substance ID: DTXSID60343980
• Wikidata: Q72474065
• Mol file: 405-09-4.mol

Synonyms:(2-Fluoro-4-methoxyphenyl)methanol;2-Fluoro-4-methoxybenzyl alcohol;405-09-4;MFCD04116336;Benzyl alcohol, 4-methoxy-6-fluoro-;SCHEMBL2290549;DTXSID60343980;BBL104031;STL557845;(2-fluoro-4-methoxy-phenyl)-methanol;(2-Fluoro-4-methoxyphenyl)methanol #;AKOS005255005;Benzoic alcohol, 4-methoxy-6-fluoro-;AB20682;(2-fluoranyl-4-methoxy-phenyl)methanol;Benzyl alcohol, 2'-fluoro-4'-methoxy-;MS-20760;CS-0194428;FT-0655306;EN300-1252069;A825144

Chemical Property of (2-Fluoro-4-methoxyphenyl)methanol

Chemical Property:

• Vapor Pressure: 0.0323mmHg at 25°C
• Refractive Index: 1.51
• Boiling Point: 232.7 °C at 760 mmHg
• PKA: 13.95±0.10(Predicted)
• Flash Point: 114.8 °C
• PSA: 29.46000
• Density: 1.187 g/cm³
• LogP: 1.32660
• Storage Temp.: 2-8°C
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 156.05865769
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

99%, ^*data from raw suppliers

2-Fluoro-4-methoxybenzyl alcohol 99% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1)CO)F

Technology Process of (2-Fluoro-4-methoxyphenyl)methanol

There total 9 articles about (2-Fluoro-4-methoxyphenyl)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: 99.0%

[13C2, D7]2-(2-fluoro-4-methoxyphenyl)propan-2-ol (128272-26-4) + aqueous THF → (2-fluoro-4-methoxyphenyl)methanol (405-09-4)

Guidance literature:

With LiAlH₄; In tetrahydrofuran; water;

Reference yield: 96.0%

2-fluoro-4-methoxy-benzaldehyde (331-64-6) → (2-fluoro-4-methoxyphenyl)methanol (405-09-4)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 0 - 20 ℃; for 3.5h;

DOI:10.1016/j.bcp.2007.01.026

Reference yield:

2-fluoro-4-methoxy-benzoic acid (394-42-3) → (2-fluoro-4-methoxyphenyl)methanol (405-09-4)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 1h; Heating;

DOI:10.1021/jm00171a031

upstream raw materials:

2-fluoro-4-methoxy-benzoic acid

2-fluoro-4-methoxy-benzaldehyde

3-fluorophenol

2-fluoro-4-hydroxybenzaldehyde

Downstream raw materials:

1-(chloromethyl)-2-fluoro-4-methoxybenzene

di-tert-butyl [2-fluoro-4-methoxybenzylamino]dicarboxylate

2-fluoro-4-methoxy-benzaldehyde

2-fluoro-L-tyrosine

Refernces

• 1、 -. "Isoindoline derivative and intermediate, preparation method, pharmaceutical composition and application thereof". Paragraph 0289; 0290. . Retrieved 2016/10/08.
• 2、 Kim, Young Ah,Sharon, Ashoke,Chu, Chung K.,Rais, Reem H.,Al Safarjalani, Omar N.,Naguib, Fardos N.M.,el Kouni, Mahmoud H.. "Synthesis, biological evaluation and molecular modeling studies of N6-benzyladenosine analogues as potential anti-toxoplasma agents". . p. 1558 - 1572. Retrieved 2008/02/08.