Pyrimido(4,5-d)pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-1,3,6-trimethyl-

Base Information

• Chemical Name: Pyrimido(4,5-d)pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-1,3,6-trimethyl-
• CAS No.: 64179-76-6
• Molecular Formula: C₉H₁₄N₄O₂
• Molecular Weight: 210.236
• DSSTox Substance ID: DTXSID90214376
• Nikkaji Number: J1.334.828F
• Wikidata: Q83090211
• Mol file: 64179-76-6.mol

Synonyms:BRN 1117894;Pyrimido(4,5-d)pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-1,3,6-trimethyl-;64179-76-6;1,3,6-trimethyl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione;5,6,7,8-Tetrahydro-1,3,6-trimethylpyrimido(4,5-d)pyrimidine-2,4(1H,3H)-dione;Maybridge1_007379;Oprea1_475654;HMS562H09;DTXSID90214376;CCG-245146;LS-136280;S 15252;5,6,7,8-Tetrahydro-1,3-dimethyl-6-methylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione

Chemical Property of Pyrimido(4,5-d)pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-1,3,6-trimethyl-

Chemical Property:

• Vapor Pressure: 0.00011mmHg at 25°C
• Boiling Point: 336.8°Cat760mmHg
• Flash Point: 157.5°C
• PSA: 59.27000
• Density: 1.35g/cm³
• LogP: -1.02530
• XLogP3: -0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 210.11167570
• Heavy Atom Count: 15
• Complexity: 363

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CC2=C(NC1)N(C(=O)N(C2=O)C)C

Technology Process of Pyrimido(4,5-d)pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-1,3,6-trimethyl-

There total 2 articles about Pyrimido(4,5-d)pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-1,3,6-trimethyl- 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: 75.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 6-Amino-1,3-dimethylbarbituric acid (6642-31-5) + methylamine (74-89-5) → 1,3,6-trimethyl-5,6,7,8-tetrahydro-1H-pyrimido[4,5-d]pyrimidine-2,4-dione (64179-76-6)

Guidance literature:

In ethanol; at 20 ℃; for 72h;

DOI:10.1515/znb-2000-0515

Reference yield:

→ 1,3,6-trimethyl-5,6,7,8-tetrahydro-1H-pyrimido[4,5-d]pyrimidine-2,4-dione (64179-76-6)

Guidance literature:

1,3-Dimethyl-4-aminouracil, Methylamin, HCHO;

upstream raw materials:

formaldehyd

6-Amino-1,3-dimethylbarbituric acid

methylamine