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1-Methylimidazolium hydrogen sulfate

Catalog NumberACM681281878-4

CAS Number681281-87-8

CategoryElectrolytes

1-Methylimidazolium hydrogen sulfate
Synonyms
1-Methylimidazolehydrogensulfate
Description
1-Methylimidazolium hydrogen sulfate is a Brønsted acidic ionic liquid that can be used as a component of a catalytic system along with chlorotrimethylsilane used in the preparation of 3,4-dihydropyrimidin-2(1H)-ones and hydroquinazoline-2,5-diones.
IUPAC Name
1-methylimidazole;sulfuric acid
Molecular Weight
180.18
Molecular Formula
Linear Formula (C6H11ClN2)2 · (AlCl3)3
Canonical SMILES
CN1C=CN=C1.OS(=O)(=O)O
InChI
1S/C4H6N2.H2O4S/c1-6-3-2-5-4-6;1-5(2,3)4/h2-4H,1H3;(H2,1,2,3,4)
InChI Key
TVEOIQKGZSIMNG-UHFFFAOYSA-N
Boiling Point
>350 °C (lit.)
Melting Point
25-35 °C
Flash Point
536.0 °F
Purity
95%
Appearance
liquid
Application
1-Methylimidazolium hydrogen sulfate serves as a versatile Brønsted acidic ionic liquid with multiple applications. It acts as a crucial component in catalytic systems alongside chlorotrimethylsilane, facilitating the synthesis of 3,4-dihydropyrimidin-2(1H)-ones and hydroquinazoline-2,5-diones. Additionally, this ionic liquid functions as a catalyst in producing biologically significant 2,5-dimethyl-N-substituted pyrroles and is valued for its reusability in synthesizing spiro[indoline-3',2-quinazoline]2',4(3H)-dione. Furthermore, it is employed in the metal recovery process, specifically the leaching of copper and zinc from brass dross, using hydrogen peroxide as an oxidizing agent.
Storage
2-8°C
Complexity
126
Covalently-Bonded Unit Count
2
Exact Mass
180.020478g/mol
Formal Charge
0
Heavy Atom Count
11
MDL Number
MFCD06798198
Monoisotopic Mass
180.020478g/mol
Refractive Index
n20/D 1.430
Rotatable Bond Count
0
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