2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)aniline - ≥95% , CAS No.1058062-64-8

CAS: 1058062-64-8 Cat. No.: A690828 Molecular Weight: 287.09 EC Number: 992-308-5 PubChem CID: 66587508
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
4-(Trifluoromethyl)aniline-2-boronic acid pinacol ester
Storage
Store at 2-8°C,Protected from light
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
50mg
A690828-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$9.90
250mg
A690828-250mg
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$19.90

$25.90
Save $6.00 (23.17%)
1g
A690828-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$72.90
5g
A690828-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$288.90
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
4-(Trifluoromethyl)aniline-2-boronic acid pinacol ester
Specifications & Purity
≥95%
Storage
Store at 2-8°C, Protected from light
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%
Names and Identifiers
Canonical SmilesB1(OC(C(O1)(C)C)(C)C)C2=C(C=CC(=C2)C(F)(F)F)N
IUPAC Name2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)aniline
InChIKeyGFSAGCJSHFVPJZ-UHFFFAOYSA-N
INCHI1S/C13H17BF3NO2/c1-11(2)12(3,4)20-14(19-11)9-7-8(13(15,16)17)5-6-10(9)18/h5-7H,18H2,1-4H3
Isomeric SMILES B1(OC(C(O1)(C)C)(C)C)C2=C(C=CC(=C2)C(F)(F)F)N
PubChem CID 66587508
Molecular Weight 287.09

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassTrifluoromethylbenzenes
Intermediate Tree Nodes Not available
Direct ParentTrifluoromethylbenzenes
Alternative Parents Aniline and substituted anilines  Dioxaborolanes  Boronic acid esters  Oxacyclic compounds  Organic metalloid salts  Primary amines  Organooxygen compounds  Organometalloid compounds  Organofluorides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Trifluoromethylbenzene - Aniline or substituted anilines - Boronic acid ester - 1,3,2-dioxaborolane - Boronic acid derivative - Organoheterocyclic compound - Oxacycle - Organic metalloid salt - Primary amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic metalloid moeity - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Alkyl halide - Amine - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeDateItem
A2615259Certificate of AnalysisNov 19, 2025 A690828
A2615260Certificate of AnalysisNov 19, 2025 A690828
A2615280Certificate of AnalysisNov 19, 2025 A690828
A2615287Certificate of AnalysisNov 19, 2025 A690828
Chemical and Physical Properties
SensitivityLight sensitive
Molecular Weight287.090 g/mol
XLogP3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass287.13 Da
Monoisotopic Mass287.13 Da
Topological Polar Surface Area44.500 Ų
Heavy Atom Count20
Formal Charge0
Complexity357.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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