1,3-dimethyl-7-(2-methylsulfinylethyl)purine-2,6-dione
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1,3-dimethyl-7-(2-methylsulfinylethyl)purine-2,6-dione
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CAS No:
3736-06-9
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Formula:
C10H14N4O3S
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Chemical Name:
1,3-dimethyl-7-(2-methylsulfinylethyl)purine-2,6-dione
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Synonyms:
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-(2-(methylsulfinyl)ethyl); 7-(2-(Methylsulfinyl)ethyl)theophylline; 7-(2-Methansulfinyl-aethyl)-1,3-dimethyl-3,7-dihydro-purin-2,6-dion; 7-(2-methanesulfinyl-ethyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione; Theophylline,7-(2-(methylsulfinyl)ethyl); T(sub 31);Expand
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CAS No:
1,3-dimethyl-7-(2-methylsulfinylethyl)purine-2,6-dione Basic Attributes
270.30800
270.07866149 g/mol
2933990090
Computed Properties
Molecular Weight:270.31
XLogP3:-1.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:270.07866149
Monoisotopic Mass:270.07866149
Topological Polar Surface Area:94.7
Heavy Atom Count:18
Complexity:403
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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