5-(Bromomethyl)-2,4,6-trichloropyrimidine

Base Information

• Chemical Name: 5-(Bromomethyl)-2,4,6-trichloropyrimidine
• CAS No.: 1780-37-6
• Molecular Formula: C5H2BrCl3N2
• Molecular Weight: 276.3458
• European Community (EC) Number: 853-073-3
• NSC Number: 26539
• DSSTox Substance ID: DTXSID80282564
• Wikidata: Q82016871
• ChEMBL ID: CHEMBL1977534

Synonyms:5-(bromomethyl)-2,4,6-trichloropyrimidine;1780-37-6;NSC26539;CHEMBL1977534;DTXSID80282564;NSC 26539;NSC-26539;SB59067;NCI60_002128;CS-0045592;5-(bromomethyl)-2,4,6-tris(chloranyl)pyrimidine;A815154;EN300-19508086;Z3247539443

Chemical Property of 5-(Bromomethyl)-2,4,6-trichloropyrimidine

Chemical Property:

• Vapor Pressure: 0.00246mmHg at 25°C
• Boiling Point: 297°Cat760mmHg
• Flash Point: 133.4°C
• Density: 1.956g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 273.84669
• Heavy Atom Count: 11
• Complexity: 125

Purity/Quality:

NLT 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C1=C(N=C(N=C1Cl)Cl)Cl)Br

Technology Process of 5-(Bromomethyl)-2,4,6-trichloropyrimidine

There total 2 articles about 5-(Bromomethyl)-2,4,6-trichloropyrimidine 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: 90.0%

5-methyl-2,4,6-trichloropyrimidine (1780-36-5) → 5-Brommethyl-2,4,6-trichlor-pyrimidin (1780-37-6)

Guidance literature:

With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile); In tetrachloromethane; for 36h; Heating;

DOI:10.1002/anie.200602778

Reference yield:

→ 5-Brommethyl-2,4,6-trichlor-pyrimidin (1780-37-6)

Guidance literature:

2,4,6-Trichlor-5-methylpyrimidin, N-Bromsuccinimid, Dibenzoylperoxid (CCl4, 30h, Kochen);

DOI:10.1021/jo01065a045

upstream raw materials:

5-methyl-2,4,6-trichloropyrimidine

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