Active Chemical RecordCatalog PreviewCatalog ready

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

CAS 1952356-62-5Formula C13H17BF3NO2MW 287.09PubChem 129946716

A pyridine derivative featuring a pinacol boronate ester and a trifluoroethyl group, serving as a versatile building block in organic synthesis, particularly for cross-coupling reactions.

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

Chemical Identity

Molecular Formula

C13H17BF3NO2

Molecular Weight

287.09 g/mol

Exact Mass

287.130443

PubChem CID

129946716

IUPAC Name

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

SMILES String

CC1(C)OB(c2cncc(CC(F)(F)F)c2)OC1(C)C

Names & Synonyms

SBOKOKDYTQYJBV-UHFFFAOYSA-NPyridine, 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(2,2,2-trifluoroethyl)-
External Identifiers
SCHEMBL17847104DTXSID301130572EN300-12601431

Catalog Overview

3-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(2,2,2-trifluoroethyl)pyridine is a meticulously designed organic compound for research applications. It incorporates a pyridine core substituted with a pinacol boronate ester at position 3 and a 2,2,2-trifluoroethyl group at position 5. The boronate ester functionality makes it an excellent precursor for Suzuki-Miyaura cross-coupling reactions, enabling the formation of new carbon-carbon bonds with aryl or vinyl halides. The trifluoroethyl moiety introduces fluorine atoms, which can impart unique electronic properties, enhance metabolic stability, or modify lipophilicity in target...

Use Context

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

3-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(2,2,2-trifluoroethyl)pyridine is a meticulously designed organic compound for research applications. It incorporates a pyridine core substituted with a pinacol boronate ester at position 3 and a 2,2,2-trifluoroethyl group at position 5. The boronate ester functionality makes it an excellent precursor for Suzuki-Miyaura cross-coupling reactions, enabling the formation of new carbon-carbon bonds with aryl or vinyl halides. The trifluoroethyl moiety introduces fluorine atoms, which can impart unique electronic properties, enhance metabolic stability, or modify lipophilicity in target molecules, making this compound valuable in medicinal chemistry and materials science research.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White to off-white crystalline solid

Physical State

Solid

Melting Point

123.0 °C

Boiling Point

281.0 °C

Density

1.4 g/cm³

Water Solubility

6.92 × 10⁻⁴ mol/L

Flash Point

187.0 °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 thoroughly with water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures.

Related Products / Graph Discovery

Related products, derivatives, keywords, and application cues for catalog discovery.

Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 293339GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

Compliance cues are non-linked reference tags and require shipment review.

Catalog navigation

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.