Chemical Identity
Molecular Formula
C13H17BF3NO2
Molecular Weight
287.09 g/mol
Exact Mass
287.130443
PubChem CID
72221112
SMILES String
CC1(C)OB(c2ccc(N)cc2C(F)(F)F)OC1(C)C
Names & Synonyms
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External Identifiers
Catalog Overview
This compound, also known as 4-Amino-2-(trifluoromethyl)phenylboronic Acid Pinacol Ester, is a key functionalized intermediate for research applications. It combines an aniline moiety, a trifluoromethyl group, and a 4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl (pinacol boronic ester) group on a benzene ring. The pinacol boronic ester is a robust and widely utilized functional group in Suzuki-Miyaura cross-coupling reactions, allowing for the formation of new carbon-carbon bonds with aryl or vinyl halides. The trifluoromethyl group is known for its strong electron-withdrawing properties and metabolic stability, making it valuable in...
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This compound, also known as 4-Amino-2-(trifluoromethyl)phenylboronic Acid Pinacol Ester, is a key functionalized intermediate for research applications. It combines an aniline moiety, a trifluoromethyl group, and a 4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl (pinacol boronic ester) group on a benzene ring. The pinacol boronic ester is a robust and widely utilized functional group in Suzuki-Miyaura cross-coupling reactions, allowing for the formation of new carbon-carbon bonds with aryl or vinyl halides. The trifluoromethyl group is known for its strong electron-withdrawing properties and metabolic stability, making it valuable in drug discovery and agrochemical research. The aniline group provides a site for further derivatization, such as acylation, alkylation, or diazotization. This chemical is intended for Research Use Only (RUO).
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White to off-white crystalline solid
Physical State
Solid
Melting Point
100.0 °C
Boiling Point
350.0 °C
Density
1.35 g/cm³
Water Solubility
Slightly soluble
Flash Point
180.0 °C
Applications / Classifications
Biological Target Reference
No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.
Preliminary Safety-Style Reference
PreliminaryPreliminary safety-style information for reference only. Not a supplier SDS.
Handling and Storage
- Handle with appropriate personal protective equipment (PPE), including gloves, eye protection, and a lab coat. Use in a well-ventilated area or a chemical fume hood to avoid inhalation. Prevent skin and eye contact. Do not ingest. Store in a cool, dry place, away from incompatible materials. Dispose of waste according to local regulations.
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Related HS Code / Compliance
Compliance cues are non-linked reference tags and require shipment review.