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2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyridine

CAS 1096689-46-1Formula C12H15BF3NO2MW 273.06PubChem 25191428

This compound is a pyridine derivative featuring a trifluoromethyl group and a pinacol boronate ester. It is primarily used as a versatile building block in organic synthesis, particularly in Suzuki-Miyaura cross-coupling reactions for the formation of carbon-carbon bonds.

Loading RDKit molecule structure...
InChIKey: QUTZULRHECZGMR-UHFFFAOYSA-NC12H15BF3NO2 | MW 273.06

Chemical Identity

Molecular Formula

C12H15BF3NO2

Molecular Weight

273.06 g/mol

Exact Mass

273.114793

PubChem CID

25191428

SMILES String

CC1(C)OB(c2cc(C(F)(F)F)ccn2)OC1(C)C

Names & Synonyms

QUTZULRHECZGMR-UHFFFAOYSA-N2-(tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyridine
External Identifiers
DTXSID70648998RefChem:251763DTXCID60599748SCHEMBL25207000AKOS015942506CS-32442CS-0279223EN300-1706310

Catalog Overview

2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyridine, with CAS 1096689-46-1, is a highly functionalized pyridine intermediate. It incorporates a trifluoromethyl group, known for its electron-withdrawing properties, and a pinacol boronate ester, a robust and widely utilized moiety for cross-coupling reactions. This chemical is a key reagent in the synthesis of complex organic molecules, offering a convenient way to introduce both a pyridine ring and a trifluoromethyl group into target structures. Its stability and reactivity make it suitable for various synthetic transformations in academic and industrial...

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Read more catalog context

2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyridine, with CAS 1096689-46-1, is a highly functionalized pyridine intermediate. It incorporates a trifluoromethyl group, known for its electron-withdrawing properties, and a pinacol boronate ester, a robust and widely utilized moiety for cross-coupling reactions. This chemical is a key reagent in the synthesis of complex organic molecules, offering a convenient way to introduce both a pyridine ring and a trifluoromethyl group into target structures. Its stability and reactivity make it suitable for various synthetic transformations in academic and industrial research settings.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White crystalline solid

Physical State

Solid

Melting Point

86.0 °C

Boiling Point

242.0 °C

Density

1.35 g/cm³

Water Solubility

9.33 × 10⁻⁴ mol/L

Flash Point

135.0 °C

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary 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 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.

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