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Structure

5-Bromo-4(3H)-pyrimidinone hemisulfate

CAS
97234-97-4
Catalog Number
ACM97234974
Category
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What is the molecular formula of 5-Bromo-4(3H)-pyrimidinone hemisulfate?

The molecular formula is C8H8Br2N4O6S.

What are the synonyms for 5-Bromo-4(3H)-pyrimidinone hemisulfate?

The synonyms include 97234-97-4, 5-Bromopyrimidin-4(3H)-one sulfate(2:1), and 5-Bromopyrimidin-4(1H)-one sulfate(2:1).

What is the molecular weight of 5-Bromo-4(3H)-pyrimidinone hemisulfate?

The molecular weight is 448.05 g/mol.

What are the component compounds of 5-Bromo-4(3H)-pyrimidinone hemisulfate?

The component compounds are 5-Bromopyrimidin-4-ol and sulfuric acid.

What is the IUPAC Name of 5-Bromo-4(3H)-pyrimidinone hemisulfate?

The IUPAC Name is 5-bromo-1H-pyrimidin-6-one;sulfuric acid.

What is the InChI of 5-Bromo-4(3H)-pyrimidinone hemisulfate?

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).

What is the InChIKey of 5-Bromo-4(3H)-pyrimidinone hemisulfate?

The InChIKey is RPCRMCXPPVJQKT-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Bromo-4(3H)-pyrimidinone hemisulfate?

The canonical SMILES is C1=C(C(=O)NC=N1)Br.C1=C(C(=O)NC=N1)Br.OS(=O)(=O)O.

What is the CAS number of 5-Bromo-4(3H)-pyrimidinone hemisulfate?

The CAS number is 97234-97-4.

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