Chemical Identity
Molecular Formula
C13H17BF3NO2
Molecular Weight
287.09 g/mol
Exact Mass
287.130443
PubChem CID
133555146
IUPAC Name
[4-(4-methylpiperidin-1-yl)-2-(trifluoromethyl)phenyl]boronic acid
SMILES String
CC1CCN(c2ccc(B(O)O)c(C(F)(F)F)c2)CC1
Names & Synonyms
External Identifiers
Catalog Overview
2-Trifluoromethyl-4-(4-methylpiperidin-1-yl)phenylboronic acid, identified by CAS 2225169-20-8, is a sophisticated organic compound with the molecular formula C13H17BF3NO2 and a molecular weight of 287. 09. This boronic acid derivative incorporates a trifluoromethyl group, known for its electron-withdrawing properties, and a 4-methylpiperidin-1-yl moiety, which can introduce steric bulk and modulate solubility. As a functionalized intermediate, it is highly valuable in synthetic chemistry, especially for forming carbon-carbon bonds through cross-coupling reactions.
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
2-Trifluoromethyl-4-(4-methylpiperidin-1-yl)phenylboronic acid, identified by CAS 2225169-20-8, is a sophisticated organic compound with the molecular formula C13H17BF3NO2 and a molecular weight of 287.09. This boronic acid derivative incorporates a trifluoromethyl group, known for its electron-withdrawing properties, and a 4-methylpiperidin-1-yl moiety, which can introduce steric bulk and modulate solubility. As a functionalized intermediate, it is highly valuable in synthetic chemistry, especially for forming carbon-carbon bonds through cross-coupling reactions. Its unique structural features make it suitable for the synthesis of novel pharmaceutical intermediates, agrochemicals, and materials science compounds in research and development laboratories.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White to off-white solid
Physical State
Solid
Melting Point
165.0 °C
Boiling Point
405.0 °C
Density
1.35 g/cm³
Water Solubility
Slightly soluble
Flash Point
250.0 °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, 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. Refer to the Safety Data Sheet (SDS) for comprehensive safety information. For research use only.
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Catalog discovery cues, not supplier-verified claims.
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Compliance cues are non-linked reference tags and require shipment review.