6-Ethoxy-9-vinyl-9H-purin-2-amine

Base Information

• Chemical Name: 6-Ethoxy-9-vinyl-9H-purin-2-amine
• CAS No.: 214201-71-5
• Molecular Formula: C9H11N5O
• Molecular Weight: 205.22
• DSSTox Substance ID: DTXSID701294069
• Mol file: 214201-71-5.mol

Synonyms:6-Ethoxy-9-vinyl-9H-purin-2-amine;214201-71-5;9-Ethenyl-6-ethoxy-9H-purin-2-amine;DTXSID701294069

Chemical Property of 6-Ethoxy-9-vinyl-9H-purin-2-amine

Chemical Property:

• Boiling Point: 469.9±55.0 °C(Predicted)
• PKA: 3.10±0.10(Predicted)
• Density: 1.39±0.1 g/cm3(Predicted)
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 205.09635999
• Heavy Atom Count: 15
• Complexity: 237

Purity/Quality:

9-ethenyl-6-ethoxy-9H-Purin-2-amine 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC1=NC(=NC2=C1N=CN2C=C)N

Technology Process of 6-Ethoxy-9-vinyl-9H-purin-2-amine

There total 2 articles about 6-Ethoxy-9-vinyl-9H-purin-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: 62.0%

ethanol (64-17-5) + 9-(2-bromoethyl)-6-chloro-9H-purin-2-amine (214201-64-6) → 2-amino-6-ethoyxy-9-vinylchloropurine (214201-71-5)

Guidance literature:

With sodium ethanolate; In N,N-dimethyl-formamide; at 20 ℃; for 2h;

DOI:10.1016/S0040-4020(98)00670-X

Reference yield:

2-Amino-6-chloropurin (10310-21-1) → 2-amino-6-ethoyxy-9-vinylchloropurine (214201-71-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 56 percent / K₂CO₃ / dimethylformamide / 48 h / 20 °C

2: 62 percent / NaOEt / dimethylformamide / 2 h / 20 °C

With sodium ethanolate; potassium carbonate; In N,N-dimethyl-formamide; 1: Alkylation / 2: Dehydrobromination;

DOI:10.1016/S0040-4020(98)00670-X

upstream raw materials:

ethanol

9-(2-bromoethyl)-6-chloro-9H-purin-2-amine

2-Amino-6-chloropurin