4-Methoxy-2,3,5,6-tetrafluorobenzyl alcohol

Base Information

• Chemical Name: 4-Methoxy-2,3,5,6-tetrafluorobenzyl alcohol
• CAS No.: 35175-79-2
• Molecular Formula: C8H6 F4 O2
• Molecular Weight: 210.128
• Hs Code.: 2942000000
• DSSTox Substance ID: DTXSID90474837
• Wikidata: Q82304973
• Mol file: 35175-79-2.mol

Synonyms:4-METHOXY-2,3,5,6-TETRAFLUOROBENZYL ALCOHOL;35175-79-2;(2,3,5,6-tetrafluoro-4-methoxyphenyl)methanol;MFCD08741397;Benzenemethanol,2,3,5,6-tetrafluoro-4-methoxy-;4-(a-Naphthyl)-2-butanone;SCHEMBL357480;DTXSID90474837;GJEGXOUIWJIPTB-UHFFFAOYSA-N;BBL101957;STL555754;AKOS016015314;AS-15717;AM20040260;4-Methoxy-2,3,5,6-tetrafluoro-benzenemethanol;A840554;A912467;J-515627;[2,3,5,6-tetrakis(fluoranyl)-4-methoxy-phenyl]methanol

Chemical Property of 4-Methoxy-2,3,5,6-tetrafluorobenzyl alcohol

Chemical Property:

• Boiling Point: 214.6±35.0 °C(Predicted)
• PKA: 12.69±0.10(Predicted)
• PSA: 29.46000
• Density: 1.458±0.06 g/cm3(Predicted)
• LogP: 1.74390
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 210.03039208
• Heavy Atom Count: 14
• Complexity: 176

Purity/Quality:

98%min ^*data from raw suppliers

4-Methoxy-2,3,5,6-tetrafluorobenzylalcohol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C(=C(C(=C1F)F)CO)F)F

Technology Process of 4-Methoxy-2,3,5,6-tetrafluorobenzyl alcohol

There total 2 articles about 4-Methoxy-2,3,5,6-tetrafluorobenzyl alcohol 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: 19.0%

methanol (67-56-1) + Pentafluoroanisole (389-40-2) → (2,3,5,6-tetrafluoro-4-methoxyphenyl)methanol (35175-79-2) + tetraphenylethane-1,2-diol (464-72-2) + (2,3,4,6-tetrafluoro-5-methoxyphenyl)methanol (136289-25-3) + (2,3,4,5-tetrafluoro-6-methoxyphenyl)methanol (136289-26-4)

Guidance literature:

With benzophenone; for 24h; Ambient temperature; Irradiation;

DOI:10.1016/S0040-4020(01)80966-2

Reference yield:

→ (2,3,5,6-tetrafluoro-4-methoxyphenyl)methanol (35175-79-2)

Guidance literature:

2,3,5,6-Tetrafluoro-4-methoxybenzoesaeure, H2SO4;

Reference yield:

(1R)-trans-3-(2-methyl-1-propenyl)-2,2-dimethylcyclopropanecarboxylic acid chloride (4489-14-9) + (2,3,5,6-tetrafluoro-4-methoxyphenyl)methanol (35175-79-2) → 4-methoxy-2,3,5,6-tetrafluorobenzyl (1R)-trans-3-(2-methyl-1-propenyl)-2,2-dimethylcyclopropanecarboxylate (454683-00-2)

Guidance literature:

With pyridine; In tetrahydrofuran; at 20 ℃; for 8h;

DOI:10.1271/bbb.68.170

upstream raw materials:

methanol

Pentafluoroanisole

Downstream raw materials:

4-methoxy-2,3,5,6-tetrafluorobenzyl (1R)-trans-3-(2-methyl-1-propenyl)-2,2-dimethylcyclopropanecarboxylate

(1R,3R)-3-Formyl-2,2-dimethyl-cyclopropanecarboxylic acid 2,3,5,6-tetrafluoro-4-methoxy-benzyl ester

Refernces

• 1、 -. "Process for producing cyclopropanecarboxylates". . . Retrieved 2008/06/13.
• 2、 -. "Ester compounds". . . Retrieved 2008/06/13.