2-Fluoro-4-iodophenol

Base Information

• Chemical Name: 2-Fluoro-4-iodophenol
• CAS No.: 2713-28-2
• Molecular Formula: C6H4FIO
• Molecular Weight: 238
• Hs Code.: 2908199090
• European Community (EC) Number: 816-080-2
• DSSTox Substance ID: DTXSID40561549
• Nikkaji Number: J801.748D
• Wikidata: Q82445393
• Mol file: 2713-28-2.mol

Synonyms:2-FLUORO-4-IODOPHENOL;2713-28-2;MFCD11109769;2-Fluoro-4-iodo-phenol;Phenol, 2-fluoro-4-iodo-;PHENOL,2-FLUORO-4-IODO-;Fluoro-4-iodophenol;O-fluoro-p-iodophenol;SCHEMBL2038516;DTXSID40561549;FDOQGGGFQVVOBN-UHFFFAOYSA-N;AMY30775;AKOS016005240;CS-W005152;MB09308;AS-10162;SY065736;A856703

Chemical Property of 2-Fluoro-4-iodophenol

Chemical Property:

• Vapor Pressure: 0.028mmHg at 25°C
• Refractive Index: 1.638
• Boiling Point: 238.1 °C at 760 mmHg
• PKA: 8.10±0.18(Predicted)
• Flash Point: 97.8 °C
• PSA: 20.23000
• Density: 2.085 g/cm³
• LogP: 2.13590
• Storage Temp.: Keep in dark place,Sealed in dry,Store in freezer, under -20°C
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 237.92909
• Heavy Atom Count: 9
• Complexity: 99.1

Purity/Quality:

99% ^*data from raw suppliers

2-Fluoro-4-iodophenol 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1I)F)O

Technology Process of 2-Fluoro-4-iodophenol

There total 4 articles about 2-Fluoro-4-iodophenol 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: 92.0%

2-fluorophenol (367-12-4) → 2-fluoro-4-iodophenol (2713-28-2)

Guidance literature:

With tert.-butylhydroperoxide; potassium iodide; In methanol; water; at 20 ℃; for 8h;

DOI:10.1016/j.tetlet.2010.02.074

Reference yield:

2-fluoro-4-iodophenylacetate (1030828-91-1) → 2-fluoro-4-iodophenol (2713-28-2)

Guidance literature:

2-fluoro-4-iodophenylacetate; With water; sodium hydroxide; In methanol; at 20 ℃; for 0.666667h;

With citric acid; In water; pH=4;

Reference yield:

(3-fluoro-4-methoxyphenyl) iodide (3824-21-3) → 2-fluoro-4-iodophenol (2713-28-2)

Guidance literature:

With hydrogen iodide; at 150 ℃;

DOI:10.1021/ja01510a021

upstream raw materials:

(3-fluoro-4-methoxyphenyl) iodide

2-fluorophenol

3-fluoro-4-methoxyaniline

2-fluoro-4-iodophenylacetate

Downstream raw materials:

(2-fluoro-4-iodo-phenoxy)-acetic acid

2-fluoro-4-(indol-1-yl)phenyl α-D-mannopyranoside

C₂₈H₂₇FN₂O₁₂

C₂₈H₂₈FNO₁₀

Refernces

• 1、 -. "ORGANIC COMPOUNDS". Page/Page column 94. . Retrieved 2014/05/24.
• 2、 Rajender Reddy,Venkateshwar,Uma Maheswari,Santhosh Kumar. "Mild and efficient oxy-iodination of alkynes and phenols with potassium iodide and tert-butyl hydroperoxide". supporting information; experimental part. p. 2170 - 2173. Retrieved 2010/06/14.