Chemical Identity
Molecular Formula
C13H16BClF3NO2
Molecular Weight
321.53 g/mol
Exact Mass
321.091471
PubChem CID
168267168
SMILES String
CC1(C)OB(c2cc(N)cc(Cl)c2C(F)(F)F)OC1(C)C
Names & Synonyms
External Identifiers
Catalog Overview
3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-4-(trifluoromethyl)aniline, identified by CAS 2803281-62-9, is a complex organic molecule with a molecular formula of C13H16BClF3NO2 and a molecular weight of 321. 53. This compound incorporates several key functional groups: an aniline moiety, a chlorine substituent, a trifluoromethyl group, and a pinacol boronic ester. These features make it a versatile building block in synthetic chemistry.
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-4-(trifluoromethyl)aniline, identified by CAS 2803281-62-9, is a complex organic molecule with a molecular formula of C13H16BClF3NO2 and a molecular weight of 321.53. This compound incorporates several key functional groups: an aniline moiety, a chlorine substituent, a trifluoromethyl group, and a pinacol boronic ester. These features make it a versatile building block in synthetic chemistry. The pinacol boronic ester group is particularly useful for Suzuki-Miyaura cross-coupling reactions, enabling the formation of new carbon-carbon bonds. The trifluoromethyl group can impart unique electronic and steric properties, often enhancing chemical stability or lipophilicity in target molecules. The aniline and chloro groups offer additional sites for further functionalization or derivatization. This chemical is suitable for research and development purposes, especially in the synthesis of novel pharmaceutical intermediates, agrochemicals, or materials science compounds.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White to off-white crystalline powder
Physical State
Solid
Melting Point
140.0 °C
Boiling Point
350.0 °C
Density
1.3 g/cm³
Water Solubility
Slightly soluble
Flash Point
200.0 °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 3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-4-(trifluoromethyl)aniline in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat, to prevent skin and eye contact. Avoid inhalation of dust or vapors. 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 comprehensive safety information before use. This product is for research use only and not for human or animal therapeutic or diagnostic use.
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Related products, derivatives, keywords, and application cues for catalog discovery.
Similar products (text references)
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Catalog discovery cues, not supplier-verified claims.
Related HS Code / Compliance
Compliance cues are non-linked reference tags and require shipment review.