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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.