Cas no 17950-40-2 (Triethyloxonium Hexafluorophosphate)

Triethyloxonium Hexafluorophosphate is a highly reactive alkylating agent commonly used in organic synthesis, particularly for the preparation of ethers and esters under mild conditions. Its strong electrophilic character makes it effective for introducing ethyl groups into nucleophilic substrates. The hexafluorophosphate counterion enhances stability and solubility in polar aprotic solvents, facilitating handling and storage. This reagent is particularly valuable in peptide chemistry and carbocation generation due to its ability to form stable intermediates. Its crystalline solid form ensures precise measurement and controlled reactivity. Triethyloxonium Hexafluorophosphate is preferred for its efficiency in demanding transformations while minimizing side reactions.
Triethyloxonium Hexafluorophosphate structure
17950-40-2 structure
Product Name:Triethyloxonium Hexafluorophosphate
CAS No:17950-40-2
MF:C6H15F6OP
MW:248.146884202957
CID:181874
PubChem ID:167684
Update Time:2025-05-28

Triethyloxonium Hexafluorophosphate Chemical and Physical Properties

Names and Identifiers

    • Triethyloxonium hexafluorophosphate(1-)
    • triethyloxidanium,hexafluorophosphate
    • Triethyloxonium Hexafluorophosphate
    • triethyloxonium hexafluorophoshpate
    • Nsc176022
    • triethyloxoniuM hexafluorophosphate(V)
    • triethyl-oxoniuhexafluorophosphate(1-)
    • Oxonium, triethyl-, hexafluorophosphate(1-)
    • TriethyloxoniuM hexafluorophosphate contains diethyl ether as stabilizer
    • FT-0637632
    • Oxonium, hexafluorophosphate(1-)
    • JRHIFBONIQGZFC-UHFFFAOYSA-N
    • J-011458
    • EINECS 241-876-6
    • NSC 176022
    • DTXSID50885001
    • MFCD00044222
    • Oxonium, triethyl-, hexafluorophosphate(1-) (1:1)
    • 17950-40-2
    • triethyloxidanium;hexafluorophosphate
    • NSC-176022
    • NS00085379
    • DTXCID701024414
    • DB-044365
    • Inchi: 1S/C6H15O.F6P/c1-4-7(5-2)6-3;1-7(2,3,4,5)6/h4-6H2,1-3H3;/q+1;-1
    • InChI Key: JRHIFBONIQGZFC-UHFFFAOYSA-N
    • SMILES: [P-](F)(F)(F)(F)(F)F.[O+](CC)(CC)CC

Computed Properties

  • Exact Mass: 248.07600
  • Monoisotopic Mass: 248.076
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 88.4
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 1A^2

Experimental Properties

  • Color/Form: Yellow substance
  • Density: g/cm3
  • Melting Point: ~145?°C (dec.)(lit.)
  • Boiling Point: °Cat760mmHg
  • Flash Point: 135?°F
  • Refractive Index: 1.582
  • PSA: 22.82000
  • LogP: 4.98080
  • Sensitiveness: Moisture Sensitive
  • Solubility: Not determined

Triethyloxonium Hexafluorophosphate Security Information

  • Hazard Statement: Corrosive/Moisture Sensitive
  • Hazardous Material transportation number:UN 2925 4.1/PG 2
  • WGK Germany:3
  • Hazard Category Code: 35-19-11
  • Safety Instruction: S26; S36/37/39; S45
  • FLUKA BRAND F CODES:10-21
  • Hazardous Material Identification: C
  • HazardClass:4.1
  • PackingGroup:III
  • Safety Term:4.1
  • Packing Group:III
  • Risk Phrases:R35
  • Packing Group:III
  • Hazard Level:4.1
  • Storage Condition:?20°C

Triethyloxonium Hexafluorophosphate Pricemore >>

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