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Formula C16H19BFNO2MW 287.1Research-use catalog entryCOA/SDS by request

CAS 917397-94-5

1-[3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropanecarbonitrile

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InChIKey: TZNIMHCBELUQIQ-UHFFFAOYSA-NC16H19BFNO2 | MW 287.1

Chemical Absolute Identifiers

CAS Number

917397-94-5

PubChem CID

69074412

Molecular Formula

C16H19BFNO2

Molecular Weight

287.1 g/mol

Exact Mass

287.149287

InChIKey

TZNIMHCBELUQIQ-UHFFFAOYSA-N

IUPAC Name

1-[3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropane-1-carbonitrile

SMILES String

CC1(C)OB(c2ccc(C3(C#N)CC3)cc2F)OC1(C)C

Physical Properties

Appearance

White to off-white solid

Physical State

Solid

Melting Point

110.0 °C

Boiling Point

350.0 °C

Density

1.2 g/cm³

Water Solubility

Insoluble

Flash Point

180.0 °C

Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.

Catalog Facts

Structural features

This is a fluorinated phenylcyclopropanecarbonitrile derivative featuring a pinacol boronic ester group, making it a versatile building block for Suzuki-Miyaura cross-coupling reactions in organic synthesis for...

Sourcing context

Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.

Research use context

Primarily used as a versatile building block in organic synthesis, especially for Suzuki-Miyaura cross-coupling reactions, to construct complex fluorinated aromatic systems for research and development.

Documentation needs

COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.

Applications & Classification

Research intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow

Safety & Handling

Handling and Storage
  • Handle with appropriate personal protective equipment (PPE) in a well-ventilated area or fume hood. Avoid inhalation, ingestion, and skin or eye contact. Store in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for detailed safety information and emergency procedures before handling this research-use chemical.

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Catalog navigation

Related catalog entries

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

CAS 2227365-42-41-(2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropane-1-carbonitrileCAS 1128269-66-82-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-5-(trifluoromethyl)pyridineCAS 1818210-26-22-(3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-2-methylpropanenitrileCAS 1971914-58-52-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethyl)pyridineCAS 1984826-57-43-Fluoro-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)pyridineCAS 2223041-77-62-Fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyridineCAS 2223054-08-6Pyridine, 3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)-CAS 2710289-82-86-Fluoro-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)pyridine