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9-Methyl-3H-Purine-2,6-Dione
[CAS# 1198-33-0]

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Identification
Name 9-Methyl-3H-Purine-2,6-Dione
Synonyms 9-Methylxanthine; P024_Sigma; St5298921
Molecular Structure CAS#: 1198-33-0, 9-Methyl-3H-Purine-2,6-Dione
Molecular Formula C6H6N4O2
Molecular Weight 166.14
CAS Registry Number 1198-33-0
EINECS 214-831-3
SMILES C2=NC1=C(NC(=O)NC1=O)[N]2C
InChI 1S/C6H6N4O2/c1-10-2-7-3-4(10)8-6(12)9-5(3)11/h2H,1H3,(H2,8,9,11,12)
InChIKey DHNIKYWYTSMDDA-UHFFFAOYSA-N
Properties
Density 1.832g/cm3 (Cal.)
Safety Data
SDS Available
References
(1) Helmut Sigel, Bert P. Operschall and Rolf Griesser. Xanthosine 5′-monophosphate (XMP). Acid–base and metal ion-binding properties of a chameleon-like nucleotide, Chem. Soc. Rev., 2009, 38, 2465.
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