2,6-dichloropyrimidine-4-carbonyl Chloride

Base Information

• Chemical Name: 2,6-dichloropyrimidine-4-carbonyl Chloride
• CAS No.: 26830-94-4
• Molecular Formula: C5H Cl3 N2 O
• Molecular Weight: 211.435
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID40452600
• Wikidata: Q82273334
• Mol file: 26830-94-4.mol

Synonyms:2,6-dichloropyrimidine-4-carbonyl Chloride;26830-94-4;2,6-DICHLOROPYRIMIDINE-4-CARBONYLCHLORIDE;MFCD08444236;SCHEMBL5683134;DTXSID40452600;NUYJCMGJLNVOML-UHFFFAOYSA-N;BBA83094;BBL102747;STL556553;AKOS000144773;3-AMINO-1-PROPANOLHYDROCHLORIDE;AB45257;DS-2131;FT-0684557;4-Pyrimidinecarbonyl chloride, 2,6-dichloro-;EN300-24330;F15036;A877129;2,6-dichloro-pyrimidine-4-carboxylic acid chloride;Z185586678

Chemical Property of 2,6-dichloropyrimidine-4-carbonyl Chloride

Chemical Property:

• Vapor Pressure: 0.001mmHg at 25°C
• Refractive Index: 1.588
• Boiling Point: 297.6°Cat760mmHg
• Flash Point: 133.8°C
• PSA: 42.85000
• Density: 1.675g/cm³
• LogP: 2.16240
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 209.915446
• Heavy Atom Count: 11
• Complexity: 166

Purity/Quality:

98%min ^*data from raw suppliers

2,6-Dichloropyrimidine-4-carbonylchloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(N=C(N=C1Cl)Cl)C(=O)Cl
• Uses: 2,6-Dichloropyrimidine-4-carbonyl Chloride,

Technology Process of 2,6-dichloropyrimidine-4-carbonyl Chloride

There total 5 articles about 2,6-dichloropyrimidine-4-carbonyl Chloride 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: 62.0%

orotic acid (65-86-1,58915-47-2,6784-70-9) → 2,4-dichloropyrimidine-6-carboxylic acid chloride (26830-94-4)

Guidance literature:

With trichlorophosphate; In N,N-dimethyl-formamide; at 110 ℃;

Reference yield: 44.0%

2,4-dihydroxypyrimidine-6-carboxylic acid (65-86-1) → 2,4-dichloropyrimidine-6-carboxylic acid chloride (26830-94-4)

Guidance literature:

With phosphorus pentachloride; trichlorophosphate; Reflux;

DOI:10.1016/j.bmc.2015.04.041

Reference yield:

2,6-dichloro-4-pyrimidinecarboxylic acid (16492-28-7) → 2,4-dichloropyrimidine-6-carboxylic acid chloride (26830-94-4)

Guidance literature:

With phosphorus pentachloride; In toluene; at 20 ℃; for 5h;

DOI:10.2174/1570180813666161013150056

upstream raw materials:

2,4-dihydroxypyrimidine-6-carboxylic acid

orotic acid

lithium orotate

2,6-dichloro-4-pyrimidinecarboxylic acid

Refernces

• 1、 -. "Boron Containing PDE4 Inhibitors". Paragraph 0767-0768. . Retrieved 2020/04/29.
• 2、 -. "PYRIDINES AND PYRIMIDINES AND USE THEREOF". Paragraph 0260; 0261. . Retrieved 2017/01/31.