8-Bromo-3-methylxanthine

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8-Bromo-3-methylxanthine

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Catalog Number	PR93703243
CAS	93703-24-3
Structure
Synonyms	8-Bromo-3-methyl-1H-purine-2,6(3H,7H)-dione
IUPAC Name	8-bromo-3-methyl-7H-purine-2,6-dione
Molecular Weight	245.03
Molecular Formula	C6H5BrN4O2
InChI	QTEQVEJOXGBDGI-UHFFFAOYSA-N
InChI Key	InChI=1S/C6H5BrN4O2/c1-11-3-2(8-5(7)9-3)4(12)10-6(11)13/h1H3,(H,8,9)(H,10,12,13)
Applications/Corresponding APIs	Linagliptin
EC Number	819-117-0
Isomeric SMILES	CN1C2=C(C(=O)NC1=O)NC(=N2)Br

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