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CAS 862095-91-8

6,7-Dihydro-2-pentafluorophenyl-5H-pyrrolo[2,1-c][1,2,4]triazolium Tetrafluoroborate TCI D4624

6,7-Dihydro-2-pentafluorophenyl-5H-pyrrolo[2,1-c][1,2,4]triazolium Tetrafluoroborate TCI D4624

Chemical Identity

CAS No.
862095-91-8
PubChem
CID 11152694·SID 253662607
Formula
C11H7BF9N3
Molecular weight
362.99 g/mol
Purity
>98.0%(HPLC)
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
2-(2,3,4,5,6-pentafluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-4-ium tetrafluoroborate
SMILES
[B-](F)(F)(F)F.C1CC2=NN(C=[N+]2C1)C3=C(C(=C(C(=C3F)F)F)F)F
InChIKey
KIWCIWCCQVTPOY-UHFFFAOYSA-N
MDL
MDL08459335
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TCI D4624, also known as 6,7-Dihydro-2-pentafluorophenyl-5H-pyrrolo[2,1-c][1,2,4]triazolium Tetrafluoroborate, is a specialized chemical compound used in catalytic reactions and organic synthesis. This compound belongs to the category of carbon-donor ligands, which are essential in transition metal catalysis. Its unique molecular structure enables it to interact effectively with various transition metals, enhancing the efficiency of chemical reactions. In laboratory settings, it is valued for its ability to accelerate reactions without significant degradation of the substrate, making it a reliable choice for synthetic processes.

The compound's stability under specific conditions makes it a preferred option for high-precision applications in research environments. Its complex molecular structure allows for versatile bonding with different types of metals, expanding its utility across a range of chemical reactions. The compound's ability to maintain the integrity of the substrate while promoting reaction rates is a key factor in its popularity among chemists. This stability and reactivity contribute to its effectiveness in both academic and industrial research.

In Indonesian laboratories, TCI D4624 is commonly used in organic chemistry and catalysis research. It supports the development of new synthetic methods and the optimization of reaction conditions. Many research institutions and universities rely on this compound to achieve high efficiency and selectivity in their chemical processes. Its consistent performance and reliability make it a valuable tool in the pursuit of scientific innovation.

TCI brochures (PDF)

  • Organic synthesis reactions benefit from TCI D4624 due to its ability to enhance reaction rates and improve product selectivity.
  • Transition metal catalysis applications utilize this compound for its effective interaction with various metals, promoting efficient chemical transformations.
  • Ligand-based catalytic systems incorporate TCI D4624 to improve the stability and performance of catalytic processes in synthetic chemistry.
  • High-precision chemical research relies on TCI D4624 for its consistent performance and reliability in controlled laboratory environments.
  • Industrial chemical processes use this compound to optimize reaction efficiency and achieve desired product yields in large-scale synthesis.

From the TCI brochure

  • Intramolecular vinylogous Stetter reaction

Brand TCI
CAS number 862095-91-8
Molecular formula —
Purity —
Category Chemistry > Catalysis and Inorganic Chemistry > Carbon-Donor Ligands [Catalysis]
Pack sizes Available in standard laboratory quantities
Physical form Solid powder (as per typical chemical compound form)
Storage Store in a cool, dry place away from moisture and direct sunlight

Data from the TCI brochure

Yield76% (D4624 (10 mol%), DBU, Toluene, rt, 18-20 h)

Source: TCI brochure RR060 (2025-01-16)

TCI D4624 should be stored in a cool, dry environment to maintain its chemical stability. It is recommended to keep the compound in a sealed container to prevent exposure to moisture and air. Proper ventilation is essential when handling this material to ensure a safe laboratory environment. Avoid contact with incompatible substances, and always use appropriate personal protective equipment when working with this compound. Due to its chemical nature, it should be stored away from heat sources and direct sunlight to preserve its effectiveness. Regular inspection of storage conditions is advised to ensure long-term stability and usability in research applications.

References cited in the TCI brochure

  1. Katherine R. Law. Extending the Stetter Reaction with 1,6‐Acceptors Chemistry – A European Journal, 2013. doi:10.1002/chem.201303435