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4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-YL)-1-(2,2,2-trifluoroethyl)-1,2,3,6-tetrahydropyridine

CAS 1219931-41-5Formula C13H21BF3NO2MW 291.12PubChem 70897287

A trifluoroethyl-substituted tetrahydropyridine derivative featuring a pinacol boronic ester, useful as a functionalized intermediate in organic synthesis for research purposes.

Loading RDKit molecule structure...
InChIKey: UFKUKPYUIMQHQV-UHFFFAOYSA-NC13H21BF3NO2 | MW 291.12

Chemical Identity

Molecular Formula

C13H21BF3NO2

Molecular Weight

291.12 g/mol

Exact Mass

291.161744

PubChem CID

70897287

IUPAC Name

4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-(2,2,2-trifluoroethyl)-3,6-dihydro-2H-pyridine

SMILES String

CC1(C)OB(C2=CCN(CC(F)(F)F)CC2)OC1(C)C

Names & Synonyms

1-(2,2,2-TRIFLUOROETHYL)-1,2,3,6-TETRAHYDROPYRIDINE-4-BORONIC ACID PINACOL ESTER1,2,3,6-tetrahydro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-(2,2,2-trifluoroethyl)-pyridineC13H21BF3NO2UFKUKPYUIMQHQV-UHFFFAOYSA-NCS-B0966
Show all synonyms
1-(2,2,2-TRIFLUOROETHYL)-1,2,3,6-TETRAHYDROPYRIDINE-4-BORONIC?ACID?PINACOL?ESTERW17589F787978
External Identifiers
MFCD18383322SCHEMBL13393554AKOS028113610AB75488AC-37699CS-14997SY070898DB-194485

Catalog Overview

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-YL)-1-(2,2,2-trifluoroethyl)-1,2,3,6-tetrahydropyridine is a research-use chemical characterized by a tetrahydropyridine core substituted with a 2,2,2-trifluoroethyl group on the nitrogen and a pinacol boronic ester at the 4-position. This compound serves as a versatile building block, particularly in palladium-catalyzed cross-coupling reactions like the Suzuki-Miyaura coupling, enabling the introduction of complex nitrogen-containing heterocyclic structures with a trifluoromethylated side chain. Its unique structural features make it valuable for synthesizing novel compounds in...

Use Context

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

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-YL)-1-(2,2,2-trifluoroethyl)-1,2,3,6-tetrahydropyridine is a research-use chemical characterized by a tetrahydropyridine core substituted with a 2,2,2-trifluoroethyl group on the nitrogen and a pinacol boronic ester at the 4-position. This compound serves as a versatile building block, particularly in palladium-catalyzed cross-coupling reactions like the Suzuki-Miyaura coupling, enabling the introduction of complex nitrogen-containing heterocyclic structures with a trifluoromethylated side chain. Its unique structural features make it valuable for synthesizing novel compounds in medicinal chemistry and materials science research.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White solid

Physical State

Solid

Melting Point

95.0 °C

Boiling Point

280.0 °C

Density

1.15 g/cm³

Water Solubility

Low

Flash Point

165.0 °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.

Similar products (text references)

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Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 293190GHS 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.