Chemical Identity
Molecular Formula
C13H15BFNO2
Molecular Weight
247.07 g/mol
Exact Mass
247.117987
PubChem CID
53217116
SMILES String
CC1(C)OB(c2cccc(C#N)c2F)OC1(C)C
Names & Synonyms
External Identifiers
Catalog Overview
2-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)benzonitrile is a chemical compound characterized by a fluorinated benzonitrile core substituted with a 4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl (pinacol boronate) group. This structure makes it a valuable functionalized intermediate in synthetic organic chemistry. The boronate ester moiety is particularly useful for carbon-carbon bond formation reactions, such as Suzuki-Miyaura cross-coupling, while the fluoro and cyano groups offer additional sites for further chemical transformations and introduce specific electronic properties. It is intended for research and...
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
2-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)benzonitrile is a chemical compound characterized by a fluorinated benzonitrile core substituted with a 4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl (pinacol boronate) group. This structure makes it a valuable functionalized intermediate in synthetic organic chemistry. The boronate ester moiety is particularly useful for carbon-carbon bond formation reactions, such as Suzuki-Miyaura cross-coupling, while the fluoro and cyano groups offer additional sites for further chemical transformations and introduce specific electronic properties. It is intended for research and development purposes only.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White to off-white solid
Physical State
Solid
Melting Point
47.0 °C
Boiling Point
272.0 °C
Density
1.35 g/cm³
Water Solubility
1.32 × 10⁻³ mol/L
Flash Point
135.0 °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
- Handle with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or under a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for detailed safety information before use. This product is for research use only and not for human or animal therapeutic or diagnostic use.
Related Products / Graph Discovery
Related products, derivatives, keywords, and application cues for catalog discovery.
Related CAS / Similar Products
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.