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2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine

CAS 2223041-89-0Formula C13H17BF3NO2MW 287.09PubChem 132398957

This compound is a pyridine derivative featuring a trifluoromethyl group and a pinacol boronic ester. It is primarily used as a versatile building block in organic synthesis, particularly for cross-coupling reactions, for research purposes.

Loading RDKit molecule structure...
InChIKey: WXTPADHCAZCMJV-UHFFFAOYSA-NC13H17BF3NO2 | MW 287.09

Chemical Identity

Molecular Formula

C13H17BF3NO2

Molecular Weight

287.09 g/mol

Exact Mass

287.130443

PubChem CID

132398957

SMILES String

Cc1nc(C(F)(F)F)ccc1B1OC(C)(C)C(C)(C)O1

Names & Synonyms

2-methyl-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridineWXTPADHCAZCMJV-UHFFFAOYSA-NH62182F758277Z2049945245
Show all synonyms
2-Methyl-6-trifluoromethylpyridine-3-boronic acid pinacol ester
External Identifiers
CS-32645CS-0368948EN300-1588789

Catalog Overview

2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine is an organoboron compound characterized by a pyridine core substituted with a methyl group, a trifluoromethyl group, and a pinacol boronic ester. The pinacol boronic ester moiety makes it a valuable reagent in Suzuki-Miyaura cross-coupling reactions, enabling the formation of new carbon-carbon bonds. The trifluoromethyl group introduces electron-withdrawing properties, which can influence the reactivity and electronic properties of target molecules. This compound serves as a key intermediate in the synthesis of complex organic molecules,...

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Read more catalog context

2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine is an organoboron compound characterized by a pyridine core substituted with a methyl group, a trifluoromethyl group, and a pinacol boronic ester. The pinacol boronic ester moiety makes it a valuable reagent in Suzuki-Miyaura cross-coupling reactions, enabling the formation of new carbon-carbon bonds. The trifluoromethyl group introduces electron-withdrawing properties, which can influence the reactivity and electronic properties of target molecules. This compound serves as a key intermediate in the synthesis of complex organic molecules, including potential pharmaceuticals and agrochemicals, for research and development purposes.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White to off-white solid

Physical State

Solid

Melting Point

105.0 °C

Boiling Point

280.0 °C

Density

1.3 g/cm³

Water Solubility

Insoluble

Flash Point

185.0 °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 (PPE) including gloves, eye protection, and a lab coat. Use in a well-ventilated area or fume hood to avoid inhalation. Avoid ingestion and skin contact. Store in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for comprehensive safety information before handling.

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