8-bromo-3,7-dimethyl-1-(oxiran-2-ylmethyl)purine-2,6-dione
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8-bromo-3,7-dimethyl-1-(oxiran-2-ylmethyl)purine-2,6-dione
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CAS No:
16877-94-4
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Formula:
C10H11BrN4O3
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Chemical Name:
8-bromo-3,7-dimethyl-1-(oxiran-2-ylmethyl)purine-2,6-dione
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Synonyms:
1-(2,3-Epoxypropyl)-8-bromtheobromin; 8-bromo-3,7-dimethyl-1-(oxiran-2-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione; 1-(|A,|A-epoxypropyl)-8-bromotheobromine; 8-bromo-3,7-dimethyl-1-oxiranylmethyl-3,7-dihydro-purine-2,6-dione; 2,6-Dioxo-8-brom-3,7-dimethyl-tetrahydropurin;
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CAS No:
8-bromo-3,7-dimethyl-1-(oxiran-2-ylmethyl)purine-2,6-dione Basic Attributes
315.12300
314.00145 g/mol
Computed Properties
Molecular Weight:315.12
XLogP3:0.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:314.00145
Monoisotopic Mass:314.00145
Topological Polar Surface Area:71
Heavy Atom Count:18
Complexity:407
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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