5-Amino-2-(trifluoromethyl)pyridine

Base Information

• Chemical Name: 5-Amino-2-(trifluoromethyl)pyridine
• CAS No.: 106877-33-2
• Molecular Formula: C6H5F3N2
• Molecular Weight: 162.114
• Hs Code.: 29333990
• European Community (EC) Number: 627-152-6
• DSSTox Substance ID: DTXSID80372232
• Nikkaji Number: J2.152.106J
• Wikidata: Q72442845
• Mol file: 106877-33-2.mol

Synonyms:5-Amino-2-(trifluoromethyl)pyridine;106877-33-2;6-(trifluoromethyl)pyridin-3-amine;3-amino-6-(trifluoromethyl)pyridine;5-Amino-2-trifluoromethylpyridine;3-Pyridinamine, 6-(trifluoromethyl)-;MFCD01862656;3-amino-6-trifluoromethylpyridine;6-(trifluoromethyl)-3-pyridinamine;SCHEMBL114542;5-amino-2trifluoromethylpyridine;5-amino-2-trifloromethylpyridine;DTXSID80372232;6-Trifluoromethyl-3-aminopyridine;6-Trifluoromethyl-3-pyridinylamine;6-Trifluoromethylpyridin-3-ylamine;3-amino-6-trifluoromethyl pyridine;3-amino-6-trifluoromethyl-pyridine;6-trifluoromethyl-pyridin-3-ylamine;BCP05913;CS-D0794;6-(trifluoromethyl)pyridine-3-amine;2-(Trifluoromethyl)-5-aminopyridine;BBL011197;STK932611;5-amino-2-(trifluoromethyl)-pyridine;5-Amino-2-(Trifluoromethyl) Pyridine;AKOS005063463;AC-2556;FS-1198;2-TRIFLUOROMETHYL-5-AMINOPYRIDINE;SY002005;5-Amino-2-(trifluoromethyl)pyridine, 96%;A1816;AM20070179;FT-0619968;EN300-100883;A801525;W-204618;Z1203161729;4-CHLORO-1,3-DIMETHYLPYRAZOLO[3,4-B]PYRIDINE-5-CARBONYLCHLORIDE

Chemical Property of 5-Amino-2-(trifluoromethyl)pyridine

Chemical Property:

• Appearance/Colour: white to light yellow crystal powder
• Vapor Pressure: 0.0821mmHg at 25°C
• Melting Point: 39-43 °C(lit.)
• Refractive Index: 1.478
• Boiling Point: 226.4 °C at 760 mmHg
• PKA: 1.49±0.22(Predicted)
• Flash Point: 90.7 °C
• PSA: 38.91000
• Density: 1.368 g/cm³
• LogP: 2.26380
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Water Solubility.: Slightly soluble in water.
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 162.04048265
• Heavy Atom Count: 11
• Complexity: 134

Purity/Quality:

98% ^*data from raw suppliers

5-?Amino-?2-?(trifluoromethyl)?pyridine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): ,Xi,C
• Hazard Codes: T,Xi,C
• Statements: 25-36/38-43-34-22
• Safety Statements: 26-36/37-45-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=NC=C1N)C(F)(F)F
• Uses: Employed in a covenient, one-pot, synthesis of azaindoles.1 Employed in a convenient, one-pot, synthesis of azaindoles.

Technology Process of 5-Amino-2-(trifluoromethyl)pyridine

There total 3 articles about 5-Amino-2-(trifluoromethyl)pyridine 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:

6-(trifluoromethyl)pyridine-3-carboxamide (386715-35-1) → 6-(trifluoromethyl)pyridin-3-amine (106877-33-2)

Guidance literature:

With sodium hydroxide; bromine; In tetrahydrofuran; at 5 - 70 ℃;

DOI:10.1021/jm7010194

Reference yield:

pyridin-3-ylamine (462-08-8) + iodotrifluoromethane (2314-97-8,263005-66-9) → 6-(trifluoromethyl)pyridin-3-amine (106877-33-2) + 3-amino-2-(trifluoromethyl)pyridine

Guidance literature:

With sulfur dioxide; zinc; Yield given. Multistep reaction. Yields of byproduct given; 1.) DMF, -60 deg C, 2.) DMF, 23 deg C, 16 h;

Reference yield:

→ 6-(trifluoromethyl)pyridin-3-amine (106877-33-2)

Guidance literature:

upstream raw materials:

pyridin-3-ylamine

iodotrifluoromethane

6-(trifluoromethyl)pyridine-3-carboxamide

Downstream raw materials:

(6-trifluoromethylpyridin-3-yl)carbamic acid phenyl ester

6-(trifluoromethyl)pyridine-3-sulfonyl chloride

6-benzyl-N-(6-(trifluoromethyl)pyridin-3-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine

5-iodo-2-(trifluoromethyl)pyridine

Refernces

• 1、 -. "2,4-Disubstituted thiazolyl derivatives". . . Retrieved 2008/06/13.