1-Butyl-3-methylimidazolium hexafluorophosphate

• CAS: 174501-64-5
• Catalog Number: ACM174501645
• Category: Imidazolium Ionic Liquids
• Molecular Weight: 284.19
• Molecular Formula: C8H15F6N2P
• Description: 1-Butyl-3-methylimidazolium hexafluorophosphate is an imidazolium-based, hydrophobic, room temperature ionic liquid (RTIL). It is an ionic liquid employed in many environmentally friendly reactions.
• Synonyms: BMIMPF6
• IUPAC Name: 1-butyl-3-methylimidazol-3-ium;hexafluorophosphate
• Canonical SMILES: CCCCN1C=C[N+](=C1)C.F[P-](F)(F)(F)(F)F
• InChI: 1S/C8H15N2.F6P/c1-3-4-5-10-7-6-9(2)8-10;1-7(2,3,4,5)6/h6-8H,3-5H2,1-2H3;/q+1;-1
• InChI Key: IXQYBUDWDLYNMA-UHFFFAOYSA-N
• Melting Point: ~70 °C
• Flash Point: Not applicable
• Density: 1.37 g/cm³
• Solubility: insoluble in Toluene
• Appearance: liquid
• Application: 1-Butyl-3-methylimidazolium hexafluorophosphate is an ionic liquid
• Storage: Store under inert gas, -20℃
• Abbreviation: BMIMPF6
• Chemical Formula: [BMIM]PF6
• Complexity: 156
• Condition To Avoid: Hygroscopic
• Covalently-Bonded Unit Count: 2
• Exact Mass: 284.087704g/mol
• Formal Charge: 0
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.
• H-Bond Acceptor: 7
• H-Bond Donor: 0
• Heavy Atom Count: 17
• MDL Number: MFCD03093295
• Monoisotopic Mass: 284.087704g/mol
• Precautionary Statements: P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
• Refractive Index: n20/D 1.41
• Rotatable Bond Count: 3
• Signal Word: Warning
• Solubility In Water: Completely miscible
• Specific Gravity: 1.37
• UNII: ZGE3N4O8Q9
• Viscosity: 267 cP

Synthetic Use

Upstream Synthesis Route 1

• 616-47-7
• 109-65-9

• 174501-64-5

Reference: [1] Australian Journal of Chemistry, 2007, vol. 60, # 12, p. 946 - 950

Upstream Synthesis Route 2

• 85100-77-2

• 174501-64-5

Reference: [1] Tetrahedron Letters, 2011, vol. 52, # 43, p. 5636 - 5639

Upstream Synthesis Route 3

• 79917-90-1

• 174501-64-5

Reference: [1]Molecules,2012,vol. 17,p. 4007 - 4027

Downstream Synthesis Route 1

• 174501-64-5

• 79917-90-1

Reference: [1] Molecules, 2012, vol. 17, # 4, p. 4007 - 4027

* For details of the synthesis route, please refer to the original source to ensure accuracy.