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HomeProduct name list1-Butyl-3-methylimidazolium hexafluorophosphate

1-Butyl-3-methylimidazolium hexafluorophosphate

Synonym(s):BMIMPF6

  • CAS NO.:174501-64-5
  • Empirical Formula: C8H15F6N2P
  • Molecular Weight: 284.18
  • MDL number: MFCD03093295
  • EINECS: 678-095-9
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-08-13 09:51:00
1-Butyl-3-methylimidazolium hexafluorophosphate Structural

What is 1-Butyl-3-methylimidazolium hexafluorophosphate?

Conductivity

1.92 mS/cm

Chemical properties

Clear pale yellow oil

The Uses of 1-Butyl-3-methylimidazolium hexafluorophosphate

those consisting of tetrafluoroborate, alkylsulfate, alkylsulfonate, carboxylate, or phosphate anions are hydrophilic and are completely dissolved in water. Dupont and coworkers first reported stable hydrophobic imidazolium salt, 1-butyl-3-methylimidazolium hexafluorophosphate ([C4mim][PF6]) in 1996. Since then, this salt has been used as a typical hydrophobic IL in many chemical reactions because its mixture with water forms a biphasic layer. Furthermore, this IL shows poor solubility in hexane or ether, which allows realization of an easy work-up process. However, [C4mim][PF6] was reported to be sensitive to the moisture at high temperature and produced hazardous hydrogen fluoride as it decomposed. Therefore, bis(trifluoromethanesulfonyl)amide (NTf2) salts are now recommended as the anion for preparing hydrophobic ILs.

The Uses of 1-Butyl-3-methylimidazolium hexafluorophosphate

1-Butyl-3-methylimidazolium hexafluorophosphate is an ionic liquid employed in many environmentally friendly reactions.

It can also be used as a medium for reactions such as:

  • Ring-closing metathesis of diene and enyne substrates in the presence of a novel recyclable ruthenium carbene complex.
  • Nickel(II)acetylacetonate catalyzed oxidation of aromatic aldehydes to the corresponding acids using dioxygen as the oxidant.
  • Lipase-catalyzed enantioselective acylation of allylic alcohols.
  • Allylation of aldehydes using tetraallylstannane to yield homoallylic alcohols.

What are the applications of Application

1-Butyl-3-methylimidazolium hexafluorophosphate is an ionic liquid

General Description

1-Butyl-3-methylimidazolium hexafluorophosphate is an imidazolium-based, hydrophobic, room temperature ionic liquid (RTIL). It can be prepared by reacting 1-methylimidazole with chlorobutane. Gaseous hydrofluorocarbons (HFCs) such as fluoromethane, fluoroethane and 1,1,2,2-tetrafluoroethane are soluble in BMIMPF6.

Properties of 1-Butyl-3-methylimidazolium hexafluorophosphate

Melting point: 6.5 °C
Boiling point: >340°C
Density  1.38 g/mL at 20 °C (lit.)
refractive index  n20/D 1.41
Flash point: >350°C
storage temp.  Store below +30°C.
solubility  Acetone, Methanol
form  Viscous Liquid
color  Clear colorless to pale yellow
Specific Gravity 1.396
PH 5 (H2O, 20℃)
Water Solubility  Miscible with dichloromethane, chloroform, ethyl acetate. Immiscible with water, diethyl ether and hexane.
Hydrolytic Sensitivity 4: no reaction with water under neutral conditions
Merck  14,1581
CAS DataBase Reference 174501-64-5(CAS DataBase Reference)
ECW 4.2 V

Safety information for 1-Butyl-3-methylimidazolium hexafluorophosphate

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P332+P313:IF SKIN irritation occurs: Get medical advice/attention.
P337+P313:IF eye irritation persists: Get medical advice/attention.

Computed Descriptors for 1-Butyl-3-methylimidazolium hexafluorophosphate

InChIKey IXQYBUDWDLYNMA-UHFFFAOYSA-N

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