1,3-dimethyl-7-(1,3-oxathiolan-2-ylmethyl)purine-2,6-dione
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1,3-dimethyl-7-(1,3-oxathiolan-2-ylmethyl)purine-2,6-dione
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CAS No:
128059-51-8
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Formula:
C11H14N4O3S
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Chemical Name:
1,3-dimethyl-7-(1,3-oxathiolan-2-ylmethyl)purine-2,6-dione
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Synonyms:
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-(1,3-oxathiolan-2-ylmethyl); 7-(1,3-Oxathiolan-2-ylmethyl)theophylline; 3,7-Dihydro-1,3-dimethyl-7-(1,3-oxathiolan-2-ylmethyl)-1H-purine-2,6-dione;
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CAS No:
Computed Properties
Molecular Weight:282.32
XLogP3:-0.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:282.07866149
Monoisotopic Mass:282.07866149
Topological Polar Surface Area:93
Heavy Atom Count:19
Complexity:407
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 1,3-dimethyl-7-(1,3-oxathiolan-2-ylmethyl)purine-2,6-dione
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