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5426-47-1

5426-47-1 Structure

5426-47-1 Structure
IdentificationBack Directory
[Name]

8-Dimethylaminotheophylline
[CAS]

5426-47-1
[Synonyms]

8-Dimethylaminotheophylline
8-(dimethylamino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
8-(Dimethylamino)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
1H-Purine-2,6-dione, 8-(dimethylamino)-3,9-dihydro-1,3-dimethyl-
[Molecular Formula]

C9H13N5O2
[MDL Number]

MFCD00526136
[MOL File]

5426-47-1.mol
[Molecular Weight]

223.23
Chemical PropertiesBack Directory
[InChI]

InChI=1S/C9H13N5O2/c1-12(2)8-10-5-6(11-8)13(3)9(16)14(4)7(5)15/h1-4H3,(H,10,11)
[InChIKey]

QOFFIYLUCIEBBX-UHFFFAOYSA-N
[SMILES]

N1C2=C(N(C)C(=O)N(C)C2=O)NC=1N(C)C
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