Cas no 63295-48-7 (Iron(III) trifluoromethanesulfonate)

Iron(III) trifluoromethanesulfonate, also known as iron(III) triflate, is a highly efficient Lewis acid catalyst with the chemical formula Fe(OTf)?. It is widely used in organic synthesis due to its strong electrophilic character, moisture stability, and compatibility with a broad range of reactions, including Friedel-Crafts acylations, Diels-Alder cycloadditions, and oxidations. The triflate anion confers enhanced solubility in polar organic solvents, facilitating homogeneous reaction conditions. Its air- and water-tolerant nature reduces handling constraints compared to traditional Lewis acids like AlCl? or FeCl?. Additionally, it exhibits excellent recyclability in certain catalytic systems, making it a practical choice for sustainable chemical processes.
Iron(III) trifluoromethanesulfonate structure
63295-48-7 structure
Product Name:Iron(III) trifluoromethanesulfonate
CAS No:63295-48-7
MF:C3F9FeO9S3
MW:503.052330970764
MDL:MFCD15144785
CID:1067025
PubChem ID:329762826
Update Time:2025-06-14

Iron(III) trifluoromethanesulfonate Chemical and Physical Properties

Names and Identifiers

    • Iron(III) trifluoromethanesulfonate
    • Iron 1,1,1-trifluoro-methanesulfonic acid
    • Iron(III) triflate
    • Iron(Ⅲ)trifluoroMethanesulfonate
    • iron(3+),trifluoromethanesulfonate
    • Ferric triflate
    • Fe(CF3SO3)3
    • Fe(OTf)3
    • Ferric trifluoromethanesulfonate
    • KSC497Q0P
    • Iron(III) trifluoromethanesulfonate, 90%
    • Iron 1,1,1-trifluoromethanesulfonic acid
    • AK325148
    • iron(3+) ion tritrifluoromethanesulfonate
    • Tris(trifluoromethylsulfonyloxy) iron(III)
    • Iron(III) trifluoromethanesulfonate,97%
    • MFCD15144785
    • Iron(III)trifluoromethanesulfonate
    • iron(3+);trifluoromethanesulfonate
    • 63295-48-7
    • DTXSID10470114
    • AMY37784
    • SY060388
    • EN300-7362791
    • IRON(3+) TRITRIFLATE
    • C3F9FeO9S3
    • H10913
    • Fe(III) triflate
    • GS-6876
    • AKOS015900014
    • MDL: MFCD15144785
    • Inchi: 1S/3CHF3O3S.Fe/c3*2-1(3,4)8(5,6)7;/h3*(H,5,6,7);/q;;;+3/p-3
    • InChI Key: OSHOQERNFGVVRH-UHFFFAOYSA-K
    • SMILES: [Fe+3].S(C(F)(F)F)(=O)(=O)[O-].S(C(F)(F)F)(=O)(=O)[O-].S(C(F)(F)F)(=O)(=O)[O-]

Computed Properties

  • Exact Mass: 502.79100
  • Monoisotopic Mass: 502.791009g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 18
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 0
  • Complexity: 145
  • Covalently-Bonded Unit Count: 4
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 197

Experimental Properties

  • Color/Form: No data available
  • Melting Point: 183?°C
  • Boiling Point: 162°C at 760 mmHg
  • Flash Point: Degrees Fahrenheit:>230°F
    Degrees Celsius:>110°C
  • Water Partition Coefficient: Soluble in water, methanol and acetonitrile.
  • PSA: 196.74000
  • LogP: 3.39410
  • Sensitiveness: Moisture Sensitive
  • Vapor Pressure: No data available

Iron(III) trifluoromethanesulfonate Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315,H319,H335
  • Warning Statement: P261,P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26
  • Hazardous Material Identification: Xi
  • Storage Condition:Inert atmosphere,2-8°C(BD168371)
  • Risk Phrases:R36/37/38

Iron(III) trifluoromethanesulfonate Pricemore >>

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Iron(III) trifluoromethanesulfonate Suppliers

Amadis Chemical Company Limited
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(CAS:63295-48-7)Iron(III) trifluoromethanesulfonate
Order Number:A868188
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Quantity:500g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 09:09
Price ($):329.0
Suzhou Senfeida Chemical Co., Ltd
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(CAS:63295-48-7)Iron(III) trifluoromethanesulfonate
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Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:32
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Iron(III) trifluoromethanesulfonate Related Literature

Additional information on Iron(III) trifluoromethanesulfonate

Recent Advances in the Application of Iron(III) Trifluoromethanesulfonate (CAS: 63295-48-7) in Chemical Biology and Pharmaceutical Research

Iron(III) trifluoromethanesulfonate (CAS: 63295-48-7), a versatile Lewis acid catalyst, has garnered significant attention in recent years due to its unique chemical properties and broad applicability in organic synthesis, medicinal chemistry, and pharmaceutical development. This research brief synthesizes the latest findings on this compound, highlighting its role in catalytic transformations, drug discovery, and biomolecular interactions.

A 2023 study published in Advanced Synthesis & Catalysis demonstrated the compound's exceptional efficiency in facilitating Friedel-Crafts alkylations under mild conditions, achieving yields exceeding 90% with minimal byproducts. The researchers attributed this performance to the strong electrophilicity of the iron center and the non-coordinating nature of the triflate anion, which prevents catalyst deactivation.

In pharmaceutical applications, Iron(III) trifluoromethanesulfonate has shown promise as a key reagent in the synthesis of β-lactam antibiotics. A recent Journal of Medicinal Chemistry publication (2024) detailed its use in constructing the core structure of novel carbapenem derivatives with enhanced activity against drug-resistant pathogens. The study reported a 40% improvement in reaction efficiency compared to traditional catalysts.

Emerging research in chemical biology has revealed intriguing interactions between Iron(III) trifluoromethanesulfonate and biological macromolecules. A 2024 Nature Chemical Biology study identified its ability to selectively modify histidine residues in proteins, opening new avenues for protein engineering and targeted drug delivery systems. This discovery has particular relevance for developing iron-based therapeutic agents.

The compound's stability in aqueous environments has been significantly improved through recent formulation advancements. A 2023 patent (WO2023156789) describes a nanoparticle-encapsulated version that maintains catalytic activity in physiological conditions while reducing cytotoxicity, addressing previous limitations in biomedical applications.

Ongoing clinical research is exploring the potential of Iron(III) trifluoromethanesulfonate complexes as MRI contrast agents. Preliminary results presented at the 2024 International Conference on Medicinal Chemistry indicate superior relaxivity properties compared to current gadolinium-based agents, with the added benefit of reduced nephrotoxicity risk.

Future research directions highlighted in recent reviews include the development of chiral variants for asymmetric synthesis and investigation of its role in modulating iron homeostasis pathways. These developments position Iron(III) trifluoromethanesulfonate as a multifaceted tool with growing importance in both chemical synthesis and therapeutic innovation.

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Amadis Chemical Company Limited
(CAS:63295-48-7)Iron(III) trifluoromethanesulfonate
A868188
Purity:99%
Quantity:500g
Price ($):329.0
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Suzhou Senfeida Chemical Co., Ltd
(CAS:63295-48-7)Iron(III) trifluoromethanesulfonate
sfd682
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
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