4-Chloro-6-(4-chlorophenoxy)pyrimidine

Base Information

• Chemical Name: 4-Chloro-6-(4-chlorophenoxy)pyrimidine
• CAS No.: 124041-02-7
• Molecular Formula: C10H6 Cl2 N2 O
• Molecular Weight: 241.076
• DSSTox Substance ID: DTXSID00154198
• Wikidata: Q83021349
• Mol file: 124041-02-7.mol

Synonyms:4-(4-chlorophenoxy)-6-chloropyriMidine;4-Chloro-6-(4-chlorophenoxy)pyrimidine;124041-02-7;Pyrimidine, 4-chloro-6-(4-chlorophenoxy)-;BRN 3610878;SCHEMBL1414937;DTXSID00154198;OFUNGGXKORELSZ-UHFFFAOYSA-N;AKOS009103815;AM806929;4-Chloro-6-(4-chloro-phenoxy)-pyrimidine;LS-134903

Chemical Property of 4-Chloro-6-(4-chlorophenoxy)pyrimidine

Chemical Property:

• Vapor Pressure: 0.000104mmHg at 25°C
• Boiling Point: 348°Cat760mmHg
• Flash Point: 164.3°C
• PSA: 35.01000
• Density: 1.414g/cm³
• LogP: 3.57570
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 239.9857182
• Heavy Atom Count: 15
• Complexity: 198

Purity/Quality:

>97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1OC2=CC(=NC=N2)Cl)Cl

Technology Process of 4-Chloro-6-(4-chlorophenoxy)pyrimidine

There total 2 articles about 4-Chloro-6-(4-chlorophenoxy)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: 93.0%

4,6-dichloropyrimidine (1193-21-1) + 4-chloro-phenol (106-48-9,82344-39-6) → 4-chloro-6-(4-chlorophenoxy)pyrimidine (124041-02-7)

Guidance literature:

With potassium carbonate; sodium iodide; In acetonitrile; at 20 ℃; for 16h; Inert atmosphere;

Reference yield: 29.0%

4,6-dichloropyrimidine (1193-21-1) + 4-chloro-phenol (106-48-9,82344-39-6) → 4-chloro-6-(4-chlorophenoxy)pyrimidine (124041-02-7) + 4,6-bis-(4-chlorophenoxy)pyrimidine (124041-04-9)

Guidance literature:

With potassium carbonate; In toluene; for 2h; Heating;

DOI:10.1007/BF01145809

Reference yield: 95.0%

(2-hydroxyethyl)(methyl)amine (109-83-1) + 4-chloro-6-(4-chlorophenoxy)pyrimidine (124041-02-7) → 2-{[6-(4-chlorophenoxy)pyrimidin-4-yl]methylamino}ethanol (607723-68-2)

Guidance literature:

In ethanol; Heating;

DOI:10.1016/j.ejmech.2005.03.019

upstream raw materials:

4,6-dichloropyrimidine

4-chloro-phenol

Downstream raw materials:

4,6-bis(ethoxycarbonylmethylthio)pyrimidine

ethyl <6-(4-chlorophenoxy)-4-pyrimidinylthio>acetate

2-{[6-(4-chlorophenoxy)pyrimidin-4-yl]methylamino}ethanol

4-({2-[6-(4-chlorophenoxy)pyrimidin-4-yl]methylamino}ethoxy)benzaldehyde