1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione
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1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione
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CAS No:
374708-38-0
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Formula:
C12H16N4O2
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Chemical Name:
1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione
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Synonyms:
NSC96093;1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione;SCHEMBL17633964;ZINC519560;NSC-96093;STL512447;1,3-dimethyl-7-(3-methylbut-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione;AKOS030490899;MCULE-5738479414;NCGC00160286-01;NCGC00160286-01!7-Prenyl-theophylline;1,3-Dimethyl-7-(3-methyl-2-butenyl)-3,7-dihydro-1H-purine-2,6-dione;1,3-dimethyl-7-(3-methylbut-2-en-1-yl)-1H-purine-2,6(3H,7H)-dione;374708-38-0
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CAS No:
1,3-dimethyl-7-(3-methylbut-2-enyl)purine-2,6-dione Basic Attributes
248.28 g/mol
248.12732577 g/mol
96093
Computed Properties
Molecular Weight:248.28
XLogP3:1.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:248.12732577
Monoisotopic Mass:248.12732577
Topological Polar Surface Area:58.4
Heavy Atom Count:18
Complexity:403
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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