N-(2,3-Dihydroxypropyl)-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxopurine-8-acetamide

Base Information

• Chemical Name: N-(2,3-Dihydroxypropyl)-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxopurine-8-acetamide
• CAS No.: 106163-62-6
• Molecular Formula: C13H19 N5 O5
• Molecular Weight: 325.3205
• DSSTox Substance ID: DTXSID00909943
• Mol file: 106163-62-6.mol

Synonyms:BRN 0575875;N-Methyl-N-beta,gamma-dihydroxypropyl theophyllinyl-8-acetamide;106163-62-6;N-(2,3-Dihydroxypropyl)-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxopurine-8-acetamide;Purine-8-acetamide, N-(2,3-dihydroxypropyl)-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxo-;DTXSID00909943;LS-126418;N-(2,3-Dihydroxypropyl)-2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)-N-methylacetamide

Chemical Property of N-(2,3-Dihydroxypropyl)-1,2,3,6-tetrahydro-N,1,3-trimethyl-2,6-dioxopurine-8-acetamide

Chemical Property:

• Vapor Pressure: 4.83E-21mmHg at 25°C
• Boiling Point: 708.1°C at 760 mmHg
• Flash Point: 382°C
• Density: 1.468g/cm³
• XLogP3: -2.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 325.13861872
• Heavy Atom Count: 23
• Complexity: 501

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)NC(=N2)CC(=O)N(C)CC(CO)O