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The molecular formula is C8H8Br2N4O6S.
The synonyms include 97234-97-4, 5-Bromopyrimidin-4(3H)-one sulfate(2:1), and 5-Bromopyrimidin-4(1H)-one sulfate(2:1).
The molecular weight is 448.05 g/mol.
The component compounds are 5-Bromopyrimidin-4-ol and sulfuric acid.
The IUPAC Name is 5-bromo-1H-pyrimidin-6-one;sulfuric acid.
The InChI is InChI=1S/2C4H3BrN2O.H2O4S/c2*5-3-1-6-2-7-4(3)8;1-5(2,3)4/h2*1-2H,(H,6,7,8);(H2,1,2,3,4).
The InChIKey is RPCRMCXPPVJQKT-UHFFFAOYSA-N.
The canonical SMILES is C1=C(C(=O)NC=N1)Br.C1=C(C(=O)NC=N1)Br.OS(=O)(=O)O.
The CAS number is 97234-97-4.
97233-10-8
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97-24-5
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