8-Bromo-3,9-dihydro-1H-purine-2,6-dione
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8-Bromo-3,9-dihydro-1H-purine-2,6-dione
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CAS No:
10357-68-3
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Formula:
C5H3BrN4O2
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Chemical Name:
8-Bromo-3,9-dihydro-1H-purine-2,6-dione
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Synonyms:
1H-Purine-2,6-dione,8-bromo-3,9-dihydro-;Xanthine,8-bromo-;1H-Purine-2,6-dione,8-bromo-3,7-dihydro-;8-Bromo-3,9-dihydro-1H-purine-2,6-dione;8-Bromopurine-2,6-diol;8-Bromoxanthine;NSC 24131
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CAS No:
8-Bromo-3,9-dihydro-1H-purine-2,6-dione Basic Attributes
231.01
231.01
600-450-3
1JQ13K1223
24131
DTXSID80145903
2933990090
8-Bromo-3,9-dihydro-1H-purine-2,6-dione Use and Manufacturing
Take xanthine 15g, was added 250mL ofwater, 7.6mL bromine, and heated to 100 ° C, i.e. the bromine color disappearsto stop the reaction, washed with a small amount of water, the reaction mixturewas cooled to room temperature, suction filtered, the filter cake was dried invacuo , the products 18.4g;Take xanthine 15g, was added 250mL ofwater, 7.6mL bromine, and heated to 100 C, i.e. the bromine color disappearsto stop the reaction, washed with a small amount of water, the reaction mixturewas cooled to room temperature, suction filtered, the filter cake was dried invacuo , the products 18.4g;
Computed Properties
Molecular Weight:231.01
XLogP3:0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:229.94394
Monoisotopic Mass:229.94394
Topological Polar Surface Area:86.9
Heavy Atom Count:12
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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8-Bromo-3,9-dihydro-1H-purine-2,6-dione
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