1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate

Basic Information

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CAS Number

412009-61-1

Molecular Formula

C6H12N2O4S

Molecular Weight

208.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Boiling Point

°Cat760mmHg

Refractive Index

1.5316 (30 ºC)

SMILES

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CCN1C=C[N+](=C1)C.OS(=O)(=O)[O-]

InChI

InChI=1S/C6H11N2.H2O4S/c1-3-8-5-4-7(2)6-8;1-5(2,3)4/h4-6H,3H2,1-2H3;(H2,1,2,3,4)/q+1;/p-1

InChIKey

HZKDSQCZNUUQIF-UHFFFAOYSA-M

LogP

0.41790

Complexity

149

Safety Information

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GHS Hazard Pictograms

H314

Hazard Statement

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Synonyms & References

English

E0754
1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate
DTXCID3029156
CHEMBL3186147
AKOS015856738
CAS-412009-61-1
1-Ethyl-3-methylimidazoliumHydrogenSulfate
A873115
412009-61-1
NCGC00260190-01
D78163
1-Ethyl-3-methylimidazolium hydrogen sulfate, 95%
AKOS025402726
BS-17032
SCHEMBL479201
1-ETHYL-3-METHYLIMIDAZOLIUM HYDROGENSULFATE
HZKDSQCZNUUQIF-UHFFFAOYSA-M
Tox21_202642
1H-Imidazolium, 3-ethyl-1-methyl-, sulfate (1:1)
1-ethyl-3-methylimidazol-3-ium;hydrogen sulfate
1-methyl-3-ethylimidazolium hydrogensulfate
X332GC6CWB
FT-0715321
1H-Imidazolium, 3-ethyl-1-methyl-, sulfate
MFCD06798195
CS-W015215
1-Ethyl-3-methylimidazolium hydrogen sulfate
DTXSID1049300
Basionics® AC 25
Basionics® AC 25
DSSTox_RID_83375

MDL Number

MFCD06798195

Customs Code

2933290090

FAQ

What are the physical and chemical properties of 1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate (CAS: 412009-61-1)?

1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate is a crystalline solid with a molecular weight of approximately 158.18 g/mol. It has a low solubility in water but is soluble in common organic solvents. The compound is moderately reactive, especially towards bases.

How is 1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate (CAS: 412009-61-1) typically synthesized?

1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate is usually synthesized via the reaction of 1-ethyl-3-methyl-1H-imidazole with sulfuric acid. The process involves the protonation of the imidazole nitrogen followed by the addition of a sulfonate group.

What industries use 1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate (CAS: 412009-61-1)?

1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate finds applications in pharmaceuticals for intermediate synthesis, as a component in sensors, and in certain polymers due to its unique structural and chemical properties.

What precautions should be taken when handling 1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate (CAS: 412009-61-1)?

When handling 1-Ethyl-3-methyl-1H-imidazol-3-ium hydrogen sulfate, proper personal protective equipment (PPE) such as gloves and goggles should be worn. Store the substance in a well-ventilated area and use a fume hood during handling. In case of spill, immediately clean up with appropriate absorbent material and consult the Safety Data Sheet (SDS) for further instructions.