ChemicalBook--->CAS DataBase List--->79917-88-7

79917-88-7

79917-88-7 Structure

79917-88-7 Structure
IdentificationBack Directory
[Name]

1,3-DIMETHYLIMIDAZOLIUM CHLORIDE
[CAS]

79917-88-7
[Synonyms]

[C1MIm]Cl
1,3-DIMETHYLIMIDAZOLIUM CHLORIDE
1,3-DimethylimidazoliumChloride>
1,3-DimethylimidazoliumChloride,98%
1,3-Dimethyl-3-imidazolium Chloride
1,3-DiMethyl-1H-iMidazol-3-iuM chloride
1H-Imidazolium,1,3-dimethyl-, chloride (1:1)
[EINECS(EC#)]

415-450-7
[Molecular Formula]

C5H9ClN2
[MDL Number]

MFCD08276366
[MOL File]

79917-88-7.mol
[Molecular Weight]

132.59
Chemical PropertiesBack Directory
[Melting point ]

125 °C
[storage temp. ]

Inert atmosphere,Room Temperature
[Water Solubility ]

Soluble in water
[form ]

powder to crystal
[color ]

White to Almost white
[InChI]

InChI=1S/C5H9N2.ClH/c1-6-3-4-7(2)5-6;/h3-5H,1-2H3;1H/q+1;/p-1
[InChIKey]

IIJSFQFJZAEKHB-UHFFFAOYSA-M
[SMILES]

[N+]1(C)C=CN(C)C=1.[Cl-]
Questions And AnswerBack Directory
[Uses]

1,3-Dimethylimidazolium chloride can be used as a solvent and a catalyst for alkylation, esterification, and polymerization reactions. 99% of this product is primarily used in the pharmaceutical industry.
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
[HS Code ]

2933.29.9000
Spectrum DetailBack Directory
[Spectrum Detail]

1,3-DIMETHYLIMIDAZOLIUM CHLORIDE(79917-88-7)1HNMR
Hazard InformationBack Directory
[Synthesis]

BASIONIC(TM) AC 75

35487-17-3

Dimethyl carbonate

616-38-6

1,3-DIMETHYLIMIDAZOLIUM CHLORIDE

79917-88-7

1. To a 250 mL round bottom flask, add 10 g of 1-methylimidazole and immerse the flask in an ice bath. Slowly add 10 mL of 37% aqueous hydrochloric acid solution dropwise. After 20 min of reaction, the solvent was removed by rotary evaporator to obtain 1-methylimidazole hydrochloride, which can be used in the next reaction without further purification. 2. In a Q-tube reactor, 3.0 g of 1-methylimidazole hydrochloride and 2.28 g of dimethyl carbonate (DMC, 0.025 mol) were added. The reaction mixture was heated to 170 °C and kept for 2 h. Upon completion of the reaction, 1,3-dimethylimidazolium chloride was obtained in quantitative yield. 3. The structure of the product was confirmed by 1H-NMR (200 MHz, DMSO-d6): δ= 9.46 (s, 1H), 7.87 (s, 2H), 3.87 (m, 6H).

[References]

[1] Molecules, 2018, vol. 23, # 11,
[2] Chemistry Letters, 2010, vol. 39, # 10, p. 1112 - 1113
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