6-Chloro-5-(2,3-dibromopropyl)-2-methyl-4-pyrimidinamine

Base Information

• Chemical Name: 6-Chloro-5-(2,3-dibromopropyl)-2-methyl-4-pyrimidinamine
• CAS No.: 85826-38-6
• Molecular Formula: C₈H₁₀Br₂ClN₃
• Molecular Weight: 343.449
• DSSTox Substance ID: DTXSID301006404
• ChEMBL ID: CHEMBL1704675
• Mol file: 85826-38-6.mol

Synonyms:BRN 5019490;85826-38-6;6-Chloro-5-(2,3-dibromopropyl)-2-methyl-4-pyrimidinamine;4-Pyrimidinamine, 6-chloro-5-(2,3-dibromopropyl)-2-methyl-;C8H10Br2ClN3;6-chloro-5-(2,3-dibromopropyl)-2-methylpyrimidin-4-amine;MLS000779409;C8-H10-Br2-Cl-N3;CHEMBL1704675;DTXSID301006404;HMS2766A15;STK363070;AKOS005453958;NCGC00246398-01;SMR000416115;LS-134434;6-Chloro-5-(2,3-dibromo-propyl)-2-methyl-pyrimidin-4-ylamine;6-Chloro-5-(2,3-dibromopropyl)-2-methylpyrimidin-4(3H)-imine

Chemical Property of 6-Chloro-5-(2,3-dibromopropyl)-2-methyl-4-pyrimidinamine

Chemical Property:

• Vapor Pressure: 1.82E-06mmHg at 25°C
• Boiling Point: 395.6°Cat760mmHg
• Flash Point: 193.1°C
• Density: 1.882g/cm³
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 342.89095
• Heavy Atom Count: 14
• Complexity: 184

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=C(C(=N1)Cl)CC(CBr)Br)N

Technology Process of 6-Chloro-5-(2,3-dibromopropyl)-2-methyl-4-pyrimidinamine

There total 4 articles about 6-Chloro-5-(2,3-dibromopropyl)-2-methyl-4-pyrimidinamine 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: 69.3%

5-Allyl-4-amino-2-methyl-6-chloropyrimidine (85826-34-2) → 4-Amino-5-(2',3'-dibromo-1'-propyl)-2-methyl-6-chloropyrimidine (85826-38-6)

Guidance literature:

With bromine; In chloroform; for 3h; Heating;

DOI:10.1007/BF00765165

Reference yield:

(2-propenyl)propanedioic acid diethyl ester (2049-80-1) → 4-Amino-5-(2',3'-dibromo-1'-propyl)-2-methyl-6-chloropyrimidine (85826-38-6)

Guidance literature:

Multi-step reaction with 4 steps

1: 72.3 percent / CH₃ONa / methanol / 10 h / Heating

2: 60.6 percent / phosphoryl chloride, dimethylaniline / 7 h

3: 50.1 percent / NH₃ / ethanol / 6 h / Heating

4: 69.3 percent / Br₂ / CHCl₃ / 3 h / Heating

With ammonia; bromine; sodium methylate; 2,3-Dimethylaniline; trichlorophosphate; In methanol; ethanol; chloroform;

DOI:10.1007/BF00765165

Reference yield:

5-Allyl-2-methyl-4,6-dihydroxypyrimidine (85826-32-0) → 4-Amino-5-(2',3'-dibromo-1'-propyl)-2-methyl-6-chloropyrimidine (85826-38-6)

Guidance literature:

Multi-step reaction with 3 steps

1: 60.6 percent / phosphoryl chloride, dimethylaniline / 7 h

2: 50.1 percent / NH₃ / ethanol / 6 h / Heating

3: 69.3 percent / Br₂ / CHCl₃ / 3 h / Heating

With ammonia; bromine; 2,3-Dimethylaniline; trichlorophosphate; In ethanol; chloroform;

DOI:10.1007/BF00765165

upstream raw materials:

5-Allyl-4-amino-2-methyl-6-chloropyrimidine

(2-propenyl)propanedioic acid diethyl ester

5-Allyl-2-methyl-4,6-dihydroxypyrimidine

5-Allyl-2-methyl-4,6-dichloropyrimidine