Chemical Identity
Molecular Formula
C12H14BF4NO2
Molecular Weight
291.05 g/mol
Exact Mass
291.105372
PubChem CID
72214337
SMILES String
CC1(C)OB(c2cc(C(F)(F)F)cc(F)n2)OC1(C)C
Names & Synonyms
External Identifiers
Catalog Overview
2-Fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyridine, identified by CAS 2223041-77-6, is a highly functionalized pyridine compound. It incorporates a fluorine atom, a trifluoromethyl group, and a pinacol boronate ester moiety. The pinacol boronate group serves as a robust and versatile handle for various cross-coupling reactions, especially the Suzuki-Miyaura coupling, enabling the formation of new carbon-carbon bonds with aryl or heteroaryl halides. The presence of fluorine and trifluoromethyl groups often imparts unique physicochemical properties, such as increased lipophilicity, metabolic...
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Read more catalog context
2-Fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyridine, identified by CAS 2223041-77-6, is a highly functionalized pyridine compound. It incorporates a fluorine atom, a trifluoromethyl group, and a pinacol boronate ester moiety. The pinacol boronate group serves as a robust and versatile handle for various cross-coupling reactions, especially the Suzuki-Miyaura coupling, enabling the formation of new carbon-carbon bonds with aryl or heteroaryl halides. The presence of fluorine and trifluoromethyl groups often imparts unique physicochemical properties, such as increased lipophilicity, metabolic stability, and altered electronic profiles, making this compound particularly relevant for the synthesis of novel fluorinated pharmaceuticals, agrochemicals, and materials in research settings. Its structure positions it as a key intermediate in the development of complex organic molecules for research use.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
white to off-white solid
Physical State
solid
Melting Point
95.0 °C
Boiling Point
280.0 °C
Density
1.4 g/cm³
Water Solubility
slightly soluble
Flash Point
120.0 °C
Applications / Classifications
Biological Target Reference
No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.
Preliminary Safety-Style Reference
PreliminaryPreliminary safety-style information for reference only. Not a supplier SDS.
Handling and Storage
- For research use only. Handle 2-Fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyridine in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat, to prevent skin and eye contact. Avoid inhalation of dust or vapors. In case of contact, rinse immediately with plenty of water. Consult the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures. Store in a cool, dry place, away from incompatible materials.
Related Products / Graph Discovery
Related products, derivatives, keywords, and application cues for catalog discovery.
Related CAS / Similar Products
Similar products (text references)
Recommended application cues
Catalog discovery cues, not supplier-verified claims.
Related HS Code / Compliance
Compliance cues are non-linked reference tags and require shipment review.