2-[3,5-Bis(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane TCI B5095

Chemical Identity

CAS No.: 69807-91-6
PubChem: CID 9798005·SID 354333363
Formula: C14H15BF6O2
Molecular weight: 340.07 g/mol
Purity: >98.0%(GC)(T)

Full identifiers (IUPAC, SMILES, InChIKey)

IUPAC: 2-[3,5-bis(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F
InChIKey: GGMXSSNJKVWXMD-UHFFFAOYSA-N

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TCI B5095, with the CAS number 69807-91-6, is a complex organoboron compound featuring trifluoromethyl groups on a phenyl ring. This reagent plays a crucial role in organic synthesis, particularly in coupling reactions such as Suzuki and Kumada. Its unique structure enables it to participate in the formation of carbon-carbon bonds, making it an essential tool in the development of pharmaceuticals, specialty chemicals, and advanced materials. Due to its reactivity and compatibility with transition metals, it is widely used in various organic reactions where bond formation is critical.

The compound's molecular structure is stable, allowing it to be a reliable reagent in laboratory settings. Its ability to engage in multiple reaction mechanisms enhances its versatility across different synthetic pathways. Additionally, its moderate stability under controlled conditions ensures safe handling and consistent performance. These properties make it a preferred choice for researchers seeking reliable and effective reagents for complex chemical syntheses.

In Indonesian laboratories, this compound is commonly used in organic chemistry research and the synthesis of complex molecules. It is frequently employed in academic and industrial settings to develop new compounds, particularly in the fields of pharmaceuticals and materials science. Its availability and effectiveness have made it a standard reagent in many research institutions and universities across Indonesia.

TCI brochures (PDF)

Suzuki-Miyaura Cross Coupling Reaction 2025-12-01 · p. 17
Boron Compounds 2025-10-07 · p. 15

Related TCI products

Organic synthesis, especially in coupling reactions like Suzuki and Kumada, due to its ability to form carbon-carbon bonds efficiently.
Pharmaceutical research, as it is used in the development of new drugs and active pharmaceutical ingredients.
Material science applications, where it contributes to the creation of advanced polymers and functional materials.
Academic research in chemistry, supporting the synthesis of complex organic compounds for educational and experimental purposes.
Industrial chemical production, where its reactivity and stability make it suitable for large-scale synthetic processes.

Brand	TCI
CAS number	69807-91-6
Molecular formula	—
Purity	—
Category	Chemistry > Organometallic Reagents > Organoboron
Pack sizes	Available in various quantities as per supplier specifications
Physical form	Solid or liquid, depending on the specific formulation
Storage	Store in a cool, dry place away from moisture and direct sunlight

This compound should be stored in a cool, dry environment to maintain its stability and prevent degradation. It is recommended to use airtight containers to minimize exposure to moisture and air, which can affect its reactivity. Due to its organoboron nature, it should be handled with care in a well-ventilated area to avoid inhalation of vapors. Avoid contact with incompatible materials such as strong oxidizers. Always use appropriate personal protective equipment, including gloves and safety goggles, when handling this reagent. Proper labeling and storage conditions are essential to ensure safe and effective use in laboratory settings.

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