7-Amino-8-bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Base Information

• Chemical Name: 7-Amino-8-bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
• CAS No.: 88795-93-1
• Molecular Formula: C7H8BrN5O2
• DSSTox Substance ID: DTXSID10551290
• Wikidata: Q82430864

Synonyms:88795-93-1;7-amino-8-bromotheophylline;DTXSID10551290;7-Amino-8-bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Chemical Property of 7-Amino-8-bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 272.98614
• Heavy Atom Count: 15
• Complexity: 325

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)N

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