2-Iodo-6-(trifluoromethyl)pyridin-3-amine

Base Information

• Chemical Name: 2-Iodo-6-(trifluoromethyl)pyridin-3-amine
• CAS No.: 920979-04-0
• Molecular Formula: C6H4 F3 I N2
• Molecular Weight: 288.011
• Hs Code.: 2933399990
• DSSTox Substance ID: DTXSID20698887
• Wikidata: Q82629444
• Mol file: 920979-04-0.mol

Synonyms:2-Iodo-6-(trifluoromethyl)pyridin-3-amine;920979-04-0;3-AMINO-2-IODO-6-(TRIFLUOROMETHYL)-PYRIDINE;3-amino-2-iodo-6-(trifluoromethyl)pyridine;2-iodo-6-trifluoromethyl-pyridin-3-ylamine;SCHEMBL830696;DTXSID20698887;MFCD11044265;AKOS015995179;DS-4051;SB82353;3-amino-2-iodo-6-trifluoromethylpyridine;2-iodo-6-trifluoromethylpyridin-3-ylamine;5-amino-6-iodo-2-(trifluoromethyl)pyridine;FT-0709832;C77151;J-509719

Chemical Property of 2-Iodo-6-(trifluoromethyl)pyridin-3-amine

Chemical Property:

• Vapor Pressure: 0.0867mmHg at 25°C
• PSA: 38.91000
• LogP: 2.86840
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 287.93713
• Heavy Atom Count: 12
• Complexity: 161

Purity/Quality:

97% ^*data from raw suppliers

2-Iodo-6-(trifluoromethyl)pyridin-3-ylamine 95.0% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=NC(=C1N)I)C(F)(F)F

Technology Process of 2-Iodo-6-(trifluoromethyl)pyridin-3-amine

There total 1 articles about 2-Iodo-6-(trifluoromethyl)pyridin-3-amine 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: 96.0%

6-(trifluoromethyl)pyridin-3-amine (106877-33-2) → 2-iodo-6-(trifluoromethyl)pyridin-3-amine (920979-04-0)

Guidance literature:

With iodine; silver sulfate; In ethanol; at 20 ℃; for 24h;

Reference yield: 86.0%

2-iodo-6-(trifluoromethyl)pyridin-3-amine (920979-04-0) + 3-(tert-butyl)benzene-1-sulfonyl chloride (2905-26-2) → 3-(1,1-dimethylethyl)-N-(2-iodo-6-trifluoromethylpyridin-3-yl)benzenesulfonamide (1314186-71-4)

Guidance literature:

2-iodo-6-(trifluoromethyl)pyridin-3-amine; 3-(tert-butyl)benzene-1-sulfonyl chloride; With pyridine; at 20 ℃;

With potassium hydroxide; In 1,4-dioxane; for 1h; Reflux;

With hydrogenchloride; In water;

Reference yield:

2-iodo-6-(trifluoromethyl)pyridin-3-amine (920979-04-0) → 5-[[1-[[3-(1,1-dimethylethyl)phenyl]sulfonyl]-5-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]methyl]-thiophene-2-carboxylic acid (1314841-37-6)

Guidance literature:

Multi-step reaction with 4 steps

1.1: pyridine / 20 °C

1.2: 1 h / Reflux

2.1: triethylamine; copper(l) iodide / bis-triphenylphosphine-palladium(II) chloride / N,N-dimethyl-formamide / 0.17 h / 120 °C / Microwave irradiation

3.1: phosphorus tribromide / dichloromethane / 96 h / 20 °C

4.1: potassium carbonate / dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂ / 1,4-dioxane; ethanol / 0.33 h / 120 °C / Microwave irradiation

With pyridine; copper(l) iodide; phosphorus tribromide; potassium carbonate; triethylamine; bis-triphenylphosphine-palladium(II) chloride; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; In 1,4-dioxane; ethanol; dichloromethane; N,N-dimethyl-formamide;

upstream raw materials:

6-(trifluoromethyl)pyridin-3-amine

Downstream raw materials:

(5-trifluoromethyl)pyrrolo[3,2-b]pyridine-2-carboxylic acid

5-[[1-[[3-(1,1-dimethylethyl)phenyl]sulfonyl]-5-(trifluoromethyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]methyl]-thiophene-2-carboxylic acid

[1-(3-(1,1-dimethylethyl)phenylsulfonyl)-5-trifluoromethyl-1H-pyrrolo[3,2-b]pyridin-2-yl]methanol

2-bromomethyl-1-(3-(1,1-dimethylethyl)phenylsulfonyl)-5-trifluoro-methyl-1H-pyrrolo[3,2-b]pyridine