4-Chloro-N,N,6-trimethylpyrimidin-2-amine

Base Information

• Chemical Name: 4-Chloro-N,N,6-trimethylpyrimidin-2-amine
• CAS No.: 5734-62-3
• Molecular Formula: C7H10 Cl N3
• Molecular Weight: 171.63
• Hs Code.: 2933599090
• European Community (EC) Number: 227-243-7
• UNII: 66WGL1RRIA
• DSSTox Substance ID: DTXSID50205947
• Nikkaji Number: J218.028F
• Wikidata: Q27264028
• ChEMBL ID: CHEMBL4086185
• Mol file: 5734-62-3.mol

Synonyms:4-Chloro-N,N,6-trimethylpyrimidin-2-amine;5734-62-3;(4-chloro-6-methyl-pyrimidin-2-yl)-dimethyl-amine;4-Chloro-N,N,6-trimethyl-2-pyrimidinamine;EINECS 227-243-7;UNII-66WGL1RRIA;66WGL1RRIA;2-N,N-DIMETHYLAMINO-4-CHLORO-6-METHYLPYRIMIDINE;2-Pyrimidinamine, 4-chloro-N,N,6-trimethyl-;(4-Chloro-6-methylpyrimidin-2-yl)dimethylamine;EC-000.1389;SCHEMBL1586905;CHEMBL4086185;DTXSID50205947;MFCD08361624;AKOS010518885;SB56348;BS-38346;4-chloro-2-dimethylamino-6-methylpyrimidine;F82294;EN300-1290853;Q27264028;F9994-8380;PYRIMIDINE, 4-CHLORO-2-(DIMETHYLAMINO)-6-METHYL-

Chemical Property of 4-Chloro-N,N,6-trimethylpyrimidin-2-amine

Chemical Property:

• Vapor Pressure: 0.0062mmHg at 25°C
• Melting Point: 35-36ºC
• Boiling Point: 272.1°Cat760mmHg
• Flash Point: 118.4°C
• PSA: 29.02000
• Density: 1.207g/cm³
• LogP: 1.50440
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 171.0563250
• Heavy Atom Count: 11
• Complexity: 129

Purity/Quality:

NLT 98% ^*data from raw suppliers

4-chloro-N,N,6-trimethylpyrimidin-2-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-Chloro-N,N,6-trimethylpyrimidin-2-amine

There total 5 articles about 4-Chloro-N,N,6-trimethylpyrimidin-2-amine 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: 59.0%

2,4-dichloro-6-methylpyrimidine (5424-21-5) + dimethyl amine (124-40-3) → crimidine (535-89-7) + (4-chloro-6-methylpyrimidin-2-yl)-dimethylamine (5734-62-3)

Guidance literature:

In tetrahydrofuran; at 30 ℃; for 18h;

DOI:10.1021/acs.jmedchem.6b01422

Reference yield: 7.0%

2,4-dichloro-6-methylpyrimidine (5424-21-5) + N,N-dimethyl-formamide dimethyl acetal (4637-24-5) → crimidine (535-89-7) + (4-chloro-6-methylpyrimidin-2-yl)-dimethylamine (5734-62-3) + [(E)-2-(2,6-Dichloro-pyrimidin-4-yl)-vinyl]-dimethyl-amine

Guidance literature:

In toluene; for 14h; Heating;

DOI:10.1002/jhet.5570330240

Reference yield:

2-amino-6-methyl-4-chloropyrimidine (5600-21-5) + methyl iodide (74-88-4) → (4-chloro-6-methylpyrimidin-2-yl)-dimethylamine (5734-62-3)

Guidance literature:

2-amino-6-methyl-4-chloropyrimidine; With sodium hydride; In tetrahydrofuran; at 0 - 20 ℃; for 0.0833333h;

methyl iodide; In tetrahydrofuran; at 20 ℃; for 16h;

DOI:10.1021/acs.jmedchem.1c01115

upstream raw materials:

2-dimethylamino-6-methyl-3H-pyrimidin-4-one

2,4-dichloro-6-methylpyrimidine

N,N-dimethyl-formamide dimethyl acetal

dimethyl amine

Downstream raw materials:

2-dimethylamino-4-methylpyrimidine

dimethyl-(4-vinyl-pyrimidin-2-yl)-amine