4,6-Dichloro-2-(2-pyridinyl)pyrimidine

Base Information

• Chemical Name: 4,6-Dichloro-2-(2-pyridinyl)pyrimidine
• CAS No.: 10235-65-1
• Molecular Formula: C9H5Cl2N3
• Molecular Weight: 226.065
• Hs Code.: 2933990090
• European Community (EC) Number: 866-428-2
• DSSTox Substance ID: DTXSID80476628
• Mol file: 10235-65-1.mol

Synonyms:10235-65-1;4,6-dichloro-2-(2-pyridinyl)pyrimidine;4,6-dichloro-2-(pyridin-2-yl)pyrimidine;4,6-dichloro-2-pyridin-2-ylpyrimidine;4,6-dichloro-2-(2-pyridyl)pyrimidine;Pyrimidine, 4,6-dichloro-2-(2-pyridinyl)-;MFCD11046810;4,6-DICHLORO-2-PYRIDIN-2-YL-PYRIMIDINE;2-pyridyl-4,6-dichloropyrimidine;SCHEMBL1442585;DTXSID80476628;NBAPGMJZRHWJAA-UHFFFAOYSA-N;SMSSF-0625463;BCP16998;AKOS012923818;AM84307;CS-W006599;SB60662;AMS_CNC_ID-1069465993;AC-27352;DS-11839;SY045498;FT-0648323;EN300-123889;4 pound not6-Dichloro-2-(pyridin-2-yl)pyrimidine;A800563;J-514120;PYRIMIDINE,4,6-DICHLORO-2-(2-PYRIDINYL)-;Z1140391417

Chemical Property of 4,6-Dichloro-2-(2-pyridinyl)pyrimidine

Chemical Property:

• Vapor Pressure: 0.027mmHg at 25°C
• Refractive Index: 1.61
• Boiling Point: 254.534 °C at 760 mmHg
• PKA: -0.57±0.19(Predicted)
• Flash Point: 132.361 °C
• PSA: 38.67000
• Density: 1.428 g/cm³
• LogP: 2.84540
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 224.9860526
• Heavy Atom Count: 14
• Complexity: 181

Purity/Quality:

98%,99%, ^*data from raw suppliers

4,6-Dichloro-2-(2-pyridinyl)pyrimidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)C2=NC(=CC(=N2)Cl)Cl

Technology Process of 4,6-Dichloro-2-(2-pyridinyl)pyrimidine

There total 4 articles about 4,6-Dichloro-2-(2-pyridinyl)pyrimidine 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: 80.0%

2-pyridin-2-yl-1H-pyrimidine-4,6-dione (10198-74-0) → 2-(pyridin-2-yl)-4,6-dichloropyrimidine (10235-65-1)

Guidance literature:

With phosphorus pentachloride; trichlorophosphate; at 106 ℃;

Reference yield:

2-Cyanopyridine (100-70-9,1232006-36-8) → 2-(pyridin-2-yl)-4,6-dichloropyrimidine (10235-65-1)

Guidance literature:

Multi-step reaction with 3 steps

1: hydrogenchloride / tetrahydrofuran; diethyl ether; water

2: sodium methylate / methanol

3: triethanolamine; trichlorophosphate / water; toluene

With hydrogenchloride; triethanolamine; sodium methylate; trichlorophosphate; In tetrahydrofuran; methanol; diethyl ether; water; toluene;

Reference yield:

pyridine-2-carboxamidine (52313-50-5) → 2-(pyridin-2-yl)-4,6-dichloropyrimidine (10235-65-1)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium methylate / methanol

2: triethanolamine; trichlorophosphate / water; toluene

With triethanolamine; sodium methylate; trichlorophosphate; In methanol; water; toluene;

upstream raw materials:

2-pyridin-2-yl-1H-pyrimidine-4,6-dione

2-Cyanopyridine

pyridine-2-carboxamidine

Downstream raw materials:

6-chloro-2-(2-pyridin-2-yl)pyrimidin-4-ylamine

ethyl N-[6-chloro-2-(2-pyridinyl)-4-pyrimidinyl]-β-alaninate

GSK-J1

N-[6-[(phenylmethyl)amino]-2-(2-pyridinyl)-4-pyrimidinyl]-β-alanine

Refernces

• 1、 -. "Novel Pyrimidine- And Triazine-Hepcidine Antagonists". . . Retrieved 2015/09/30.
• 2、 -. "Aryl and heterocyclyl substituted pyrimidine derivatives as anti-coagulants". Example Pr3. . Retrieved 2008/06/13.