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

CAS 2223048-94-8Formula C12H14BClF3NO2MW 307.5PubChem 133662159

A pyridine derivative featuring a chloro group, a trifluoromethyl group, and a pinacol boronate ester, primarily used as a versatile building block in organic synthesis for research purposes.

Loading RDKit molecule structure...
InChIKey: RUKWLLTYXLNDLD-UHFFFAOYSA-NC12H14BClF3NO2 | MW 307.5

Chemical Identity

Molecular Formula

C12H14BClF3NO2

Molecular Weight

307.5 g/mol

Exact Mass

307.075821

PubChem CID

133662159

SMILES String

CC1(C)OB(c2cc(C(F)(F)F)ncc2Cl)OC1(C)C

External Identifiers
CS-33072

Catalog Overview

5-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)pyridine is a highly functionalized pyridine compound. It incorporates a trifluoromethyl group, a chlorine atom, and a pinacol boronate ester moiety. This combination of functional groups makes it a valuable intermediate for synthesizing complex organic molecules, particularly in pharmaceutical and agrochemical research. The boronate ester is amenable to various cross-coupling reactions, while the chloro and trifluoromethyl groups offer sites for further derivatization or provide specific electronic and steric properties to target molecules.

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow
Read more catalog context

5-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)pyridine is a highly functionalized pyridine compound. It incorporates a trifluoromethyl group, a chlorine atom, and a pinacol boronate ester moiety. This combination of functional groups makes it a valuable intermediate for synthesizing complex organic molecules, particularly in pharmaceutical and agrochemical research. The boronate ester is amenable to various cross-coupling reactions, while the chloro and trifluoromethyl groups offer sites for further derivatization or provide specific electronic and steric properties to target molecules. This compound is intended for Research Use Only (RUO).

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White to off-white crystalline solid

Physical State

Solid

Melting Point

100.0 °C

Boiling Point

280.0 °C

Density

1.4 g/cm³

Water Solubility

Insoluble

Flash Point

160.0 °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. Refer to the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures. Store in a cool, dry place, away from incompatible materials.

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