9-(2-Hydroxyethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

Base Information

• Chemical Name: 9-(2-Hydroxyethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
• CAS No.: 15017-36-4
• Molecular Formula: C₉H₁₂N₄O₃
• Molecular Weight: 224.219
• DSSTox Substance ID: DTXSID90521017
• Wikidata: Q82385233
• Mol file: 15017-36-4.mol

Synonyms:15017-36-4;SCHEMBL10598646;DTXSID90521017;9-(2-Hydroxyethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

Chemical Property of 9-(2-Hydroxyethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

Chemical Property:

• XLogP3: -1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 224.09094026
• Heavy Atom Count: 16
• Complexity: 322

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=C(C(=O)N(C1=O)C)N=CN2CCO

Technology Process of 9-(2-Hydroxyethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

There total 5 articles about 9-(2-Hydroxyethyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione 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:

6-(2-hydroxyethylamino)-1,3-dimethyl-5-nitrosopyrimidine-2,4(1H,3H)-dione (4217-38-3) → (hydroxy-2 ethyl)-9 theophylline (15017-36-4)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂ / Raney nickel / methanol / atmospheric pressure

2: formamide / 0.5 h / 190 °C

With hydrogen; nickel; In methanol; formamide;

DOI:10.1002/jhet.5570220127

Reference yield:

formic acid (64-18-6) + 5-Amino-6-(2-hydroxy-ethylamino)-1,3-dimethyl-1H-pyrimidine-2,4-dione (61336-99-0) → (hydroxy-2 ethyl)-9 theophylline (15017-36-4)

Guidance literature:

In formamide; at 190 ℃; for 0.5h; Yield given;

DOI:10.1002/jhet.5570220127

Reference yield:

Acetic acid 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-9-yl)-ethyl ester (96474-40-7) → (hydroxy-2 ethyl)-9 theophylline (15017-36-4)

Guidance literature:

In hydrogenchloride; Yield given; Heating;

DOI:10.1002/jhet.5570220127

upstream raw materials:

formic acid

5-Amino-6-(2-hydroxy-ethylamino)-1,3-dimethyl-1H-pyrimidine-2,4-dione

Acetic acid 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-9-yl)-ethyl ester

6-(2-hydroxyethylamino)-1,3-dimethyl-5-nitrosopyrimidine-2,4(1H,3H)-dione

Downstream raw materials:

bromo-8 (hydroxy-2 ethyl)-9 theophylline

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 15017-36-4 1H-Purine-2,6-dione, 3,9-dihydro-9-(2-hydroxyethyl)-1,3-dimethyl-

Send

Send

Metric Ton KG G Pound L ML

Send

Send