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(2,6-Bis(trifluoromethyl)pyridin-4-yl)boronic acid

CAS 1653975-45-1Formula C7H4BF6NO2MW 258.92PubChem 72216305

(2,6-Bis(trifluoromethyl)pyridin-4-yl)boronic acid is a highly fluorinated pyridine derivative featuring a boronic acid group. This compound serves as a versatile building block in organic synthesis, particularly for creating complex molecules with enhanced chemical and biological properties due to the electron-withdrawing trifluoromethyl groups. It is intended for research use only.

Loading RDKit molecule structure...
InChIKey: VHHZSZSIBHKBEO-UHFFFAOYSA-NC7H4BF6NO2 | MW 258.92

Chemical Identity

Molecular Formula

C7H4BF6NO2

Molecular Weight

258.92 g/mol

Exact Mass

259.023928

PubChem CID

72216305

IUPAC Name

[2,6-bis(trifluoromethyl)-4-pyridinyl]boronic acid

SMILES String

OB(O)c1cc(C(F)(F)F)nc(C(F)(F)F)c1

Names & Synonyms

2,6-Bis(trifluoromethyl)pyridine-4-boronic acid[2,6-BIS(TRIFLUOROMETHYL)PYRIDIN-4-YL]BORONIC ACIDVHHZSZSIBHKBEO-UHFFFAOYSA-N[2,6-bis(trifluoromethyl)-4-pyridyl]boronic acid
External Identifiers
starbld0018328SCHEMBL28454234MFCD22545899AKOS017344855AB80804CS-35401

Catalog Overview

(2,6-Bis(trifluoromethyl)pyridin-4-yl)boronic acid, with CAS 1653975-45-1, is a specialized organoboron compound characterized by a pyridine core substituted with two electron-withdrawing trifluoromethyl groups at positions 2 and 6, and a boronic acid group at position 4. The presence of the trifluoromethyl groups significantly influences the electronic properties of the pyridine ring, making it a valuable reagent in synthetic methodologies. Boronic acids are widely utilized in various cross-coupling reactions, such as the Suzuki-Miyaura coupling, for forming carbon-carbon bonds. This compound is particularly useful for...

Use Context

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

(2,6-Bis(trifluoromethyl)pyridin-4-yl)boronic acid, with CAS 1653975-45-1, is a specialized organoboron compound characterized by a pyridine core substituted with two electron-withdrawing trifluoromethyl groups at positions 2 and 6, and a boronic acid group at position 4. The presence of the trifluoromethyl groups significantly influences the electronic properties of the pyridine ring, making it a valuable reagent in synthetic methodologies. Boronic acids are widely utilized in various cross-coupling reactions, such as the Suzuki-Miyaura coupling, for forming carbon-carbon bonds. This compound is particularly useful for introducing a fluorinated pyridine moiety into target molecules, which can be advantageous in medicinal chemistry and materials science for modifying physicochemical properties like lipophilicity, metabolic stability, and binding affinity. This product is for research use only.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White to off-white crystalline powder

Physical State

Solid

Melting Point

175.0 °C

Boiling Point

390.0 °C

Density

1.55 g/cm³

Water Solubility

Slightly soluble

Flash Point

230.0 °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 (2,6-Bis(trifluoromethyl)pyridin-4-yl)boronic acid with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or under a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of 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. This chemical is for research use only and not for human or animal therapeutic or diagnostic use.

Related Products / Graph Discovery

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

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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: 29339990GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

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