Cas no 156241-41-7 (1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate)

1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate is a highly fluorinated sulfonate ester known for its strong electrophilic properties and thermal stability. Its electron-withdrawing hexafluoroisopropyl group enhances reactivity, making it a valuable reagent in organic synthesis, particularly for introducing trifluoromethanesulfonate (triflate) groups. The compound’s resistance to hydrolysis and decomposition under harsh conditions ensures reliability in demanding applications, such as catalysis and polymer chemistry. Its low nucleophilicity and high solubility in organic solvents further contribute to its utility in facilitating efficient transformations, including alkylations and acylations. This reagent is particularly favored in fluorination reactions and the preparation of advanced intermediates in pharmaceutical and materials science research.
1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate structure
156241-41-7 structure
Product Name:1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate
CAS No:156241-41-7
MF:C4HF9O3S
MW:300.099571943283
MDL:MFCD02093340
CID:107404
PubChem ID:87560955
Update Time:2025-06-08

1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate Chemical and Physical Properties

Names and Identifiers

    • Methanesulfonic acid,1,1,1-trifluoro-, 2,2,2-trifluoro-1-(trifluoromethyl)ethyl ester
    • 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate
    • HEXAFLUOROISOPROPYL TRIFLUOROMETHANESULFONATE
    • 1,1,1,3,3,3-Hexafluoroisopropyl
    • 1,1,1,3,3,3-hexafluoroisopropyl triflate
    • 1,1,1,3,3,3-Hexafluoroisopropyltrifluoromethanesulphonate
    • 2H-Perfluoroprop-2-yl trifluoromethanesulphonate
    • HEXAFLUOROIOSPROPYL TRIFLUOROMETHANESULFONATE
    • hexafluoroisopropyl trifluoromethanesulphonate
    • Trifluoromethanesulfonic Acid 1,1,1,3,3,3-Hexafluoroisopropyl Ester
    • 1-(TRIFLUOROMETHYL)-2,2,2-TRIFLUOROETHYL TRIFLATE
    • Methanesulfonic acid, trifluoro-, 2,2,2-trifluoro-1-(trifluoroMethyl)ethyl ester
    • 1,1,1,3,3,3-hexafluoropropan-2-yl trifluoromethanesulfonate
    • 1,1,1,3,3,3-Hexafluoroisopropyl trifluoromethanesulphonate
    • HEXAFLUOROISOPROPYLTRIFLUOROMETHANESULFONATE
    • 1,1,1,3,3,3-Hexafluoroprop-2-yl triflate
    • PC3808
    • 4909AD
    • STL557358
    • BBL103548
    • FCH2712935
    • 1,1,1,3,3,3-Hexafluoroisopr
    • 2H-Perfluoroprop-2-yltrifluoromethanesulphonate97%
    • 2H-Perfluoroprop-2-yl trifluoromethanesulphonate 97%
    • 1,1,1,3,3,3-Hexafluoroisopropyltrifluoromethanesulphonate97%
    • 1,1,1,3,3,3-Hexafluoroisopropyl trifluoromethanesulphonate 97%
    • 156241-41-7
    • AS-78492
    • Methanesulfonic acid, 1,1,1-trifluoro-, 2,2,2-trifluoro-1-(trifluoromethyl)ethyl ester
    • FT-0676353
    • NRHQWNHARTXNOE-UHFFFAOYSA-N
    • H1276
    • AKOS007930774
    • SCHEMBL4119223
    • T71855
    • MFCD02093340
    • A809726
    • DB-230513
    • MDL: MFCD02093340
    • Inchi: 1S/C4HF9O3S/c5-2(6,7)1(3(8,9)10)16-17(14,15)4(11,12)13/h1H
    • InChI Key: NRHQWNHARTXNOE-UHFFFAOYSA-N
    • SMILES: S(C(F)(F)F)(=O)(=O)OC(C(F)(F)F)C(F)(F)F

Computed Properties

  • Exact Mass: 299.95000
  • Monoisotopic Mass: 299.95026852g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 340
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 51.8
  • XLogP3: 3.2

Experimental Properties

  • PSA: 51.75000
  • LogP: 3.42660

1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate Security Information

1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate Pricemore >>

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1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate Related Literature

Additional information on 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate

Comprehensive Guide to 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate (CAS No. 156241-41-7)

1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate (CAS No. 156241-41-7) is a highly specialized fluorinated compound widely recognized for its unique chemical properties and applications in advanced synthesis. This compound, often abbreviated as HFIP-OTf, belongs to the class of trifluoromethanesulfonate esters, which are pivotal in modern organic chemistry due to their exceptional reactivity and stability under various conditions.

The growing interest in fluorinated compounds like 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate is driven by their versatility in pharmaceuticals, agrochemicals, and materials science. Researchers and industry professionals frequently search for terms such as "HFIP-OTf applications", "CAS 156241-41-7 synthesis", and "fluorinated sulfonates in catalysis", reflecting the compound's relevance in cutting-edge research.

One of the standout features of 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate is its role as a highly efficient activating agent. Its strong electron-withdrawing properties make it invaluable in reactions requiring robust leaving groups, such as glycosylation and polymerization. The compound's thermal stability and solubility in organic solvents further enhance its utility in complex synthetic pathways.

In recent years, the demand for sustainable chemistry solutions has surged, and HFIP-OTf aligns with this trend. Its ability to facilitate reactions at lower temperatures reduces energy consumption, addressing the global push for green chemistry. Searches like "eco-friendly fluorinated reagents" and "HFIP-OTf in green synthesis" highlight this intersection of innovation and environmental responsibility.

The compound's structural uniqueness also makes it a subject of interest in material science. For instance, its incorporation into polymers can impart enhanced thermal resistance and chemical inertness, properties critical for high-performance coatings and electronics. Queries such as "fluorinated sulfonates in polymer science" and "CAS 156241-41-7 material applications" underscore its multidisciplinary appeal.

From a safety and handling perspective, 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate requires standard laboratory precautions, similar to other reactive sulfonates. Proper storage in anhydrous conditions and the use of personal protective equipment are recommended to maintain its integrity and ensure safe usage.

In summary, 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate (CAS No. 156241-41-7) is a cornerstone in modern synthetic chemistry, bridging gaps between pharmaceutical innovation, sustainable practices, and advanced material design. Its continued exploration promises to unlock new possibilities across scientific disciplines.

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