4-(Benzyloxy)-6-chloropyrimidin-2-amine

Base Information

• Chemical Name: 4-(Benzyloxy)-6-chloropyrimidin-2-amine
• CAS No.: 210992-85-1
• Molecular Formula: C11H10ClN3O
• Molecular Weight: 235.673
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID80594972
• Wikidata: Q72457109
• Mol file: 210992-85-1.mol

Synonyms:210992-85-1;4-(benzyloxy)-6-chloropyrimidin-2-amine;4-Chloro-6-(phenylmethoxy)-2-pyrimidinamine;4-chloro-6-phenylmethoxypyrimidin-2-amine;4-benzyloxy-6-chloro-pyrimidin-2-amine;SCHEMBL3930094;DTXSID80594972;LFDDHABRCWHVEF-UHFFFAOYSA-N;AKOS015910100;SB58600;2-amino-4-benzyloxy-6-chloropyrimidine;A815136

Chemical Property of 4-(Benzyloxy)-6-chloropyrimidin-2-amine

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.637
• Boiling Point: 448.471 °C at 760 mmHg
• Flash Point: 225.028 °C
• PSA: 61.03000
• Density: 1.348 g/cm³
• LogP: 2.87240
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 235.0512396
• Heavy Atom Count: 16
• Complexity: 211

Purity/Quality:

97% ^*data from raw suppliers

4-CHLORO-6-(PHENYLMETHOXY)-2-PYRIMIDINAMINE 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=CC(=NC(=N2)N)Cl

Technology Process of 4-(Benzyloxy)-6-chloropyrimidin-2-amine

There total 2 articles about 4-(Benzyloxy)-6-chloropyrimidin-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: 98.0%

2-Amino-4,6-dichloropyrimidine (56-05-3) + benzyl alcohol (100-51-6,185532-71-2) → 2-amino-4-(benzyloxy)-6-chloropyrimidine (210992-85-1)

Guidance literature:

benzyl alcohol; With sodium hydride; In tetrahydrofuran;

2-Amino-4,6-dichloropyrimidine; In tetrahydrofuran; N,N-dimethyl-formamide;

Reference yield:

2-Amino-4,6-dichloropyrimidine (56-05-3) → 2-amino-4-(benzyloxy)-6-chloropyrimidine (210992-85-1)

Guidance literature:

benzyl alcohol; With sodium hydride; In tetrahydrofuran; at 0 - 25 ℃; for 0.5h;

2-Amino-4,6-dichloropyrimidine; In tetrahydrofuran; N,N-dimethyl-formamide; at 100 ℃; for 1h;

Reference yield: 83.0%

2-amino-4-(benzyloxy)-6-chloropyrimidine (210992-85-1) + p-toluidine (106-49-0,12221-03-3) → 2-amino-6-chloro-4-(4-(p-tolyldiazenyl)benzyloxy)pyrimidine

Guidance literature:

p-toluidine; With hydrogenchloride; sodium nitrite; In water; at 0 - 5 ℃;

2-amino-4-(benzyloxy)-6-chloropyrimidine; In water; for 0.5h;

With potassium acetate; In water; at 20 ℃; for 16h;

DOI:10.5560/ZNB.2014-4107

upstream raw materials:

2-Amino-4,6-dichloropyrimidine

benzyl alcohol

Downstream raw materials:

[4-benzyloxy-6-(1-triisopropylsilanyl-1H-indol-4-yl)-pyrimidin-2-yl]-pyridin-3-yl-amine