8-Benzyl-7-ethyl-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione

Base Information

• Chemical Name: 8-Benzyl-7-ethyl-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione
• CAS No.: 5442-25-1
• Molecular Formula: C16H18N4O2
• Molecular Weight: 298.3397
• NSC Number: 14323
• DSSTox Substance ID: DTXSID00279850
• Wikidata: Q82012731

Synonyms:5442-25-1;8-Benzyl-7-ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione;8-benzyl-7-ethyl-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione;NSC14323;DTXSID00279850;NSC 14323;NSC-14323;8-benzyl-7-ethyl-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

Chemical Property of 8-Benzyl-7-ethyl-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione

Chemical Property:

• Vapor Pressure: 5.89E-11mmHg at 25°C
• Boiling Point: 521.1°Cat760mmHg
• Flash Point: 268.9°C
• Density: 1.27g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 298.14297583
• Heavy Atom Count: 22
• Complexity: 449

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CC3=CC=CC=C3

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