3-Bromo-2-hydroxy-5-trifluoromethylpyridine - ≥97% , CAS No.76041-73-1

CAS: 76041-73-1 Cat. No.: B186456 Molecular Weight: 242
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
AM62726 | 3-Bromo-2-hydroxy-5-trifluoromethylpyridine | 3-bromo-5-(trifluoromethyl)pyridin-2(1H)-one | BBL103729 | A9650 | AB12658 | (S)-2-AMINO-2-METHYLBUTYRIC ACID | 3-Bromo-5-trifluoromethyl-2-pyridone | AKOS005255203 | (l)-beta-cyclopropylalanine | J-
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
1g
B186456-1g
3

$9.90

$14.90
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5g
B186456-5g
8

$16.90

$25.90
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25g
B186456-25g
2

$35.90

$53.90
Save $18.00 (33.40%)
100g
B186456-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$139.90

$209.90
Save $70.00 (33.35%)
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

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

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Literature proof

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

Specifications

Synonyms
AM62726 | 3-Bromo-2-hydroxy-5-trifluoromethylpyridine | 3-bromo-5-(trifluoromethyl)pyridin-2(1H)-one | BBL103729 | A9650 | AB12658 | (S)-2-AMINO-2-METHYLBUTYRIC ACID | 3-Bromo-5-trifluoromethyl-2-pyridone | AKOS005255203 | (l)-beta-cyclopropylalanine | J-
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid504767418
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504767418
Canonical SmilesC1=C(C(=O)NC=C1C(F)(F)F)Br
IUPAC Name3-bromo-5-(trifluoromethyl)-1H-pyridin-2-one
InChIKeyUWHKLLYQUQPOQK-UHFFFAOYSA-N
INCHI1S/C6H3BrF3NO/c7-4-1-3(6(8,9)10)2-11-5(4)12/h1-2H,(H,11,12)
Isomeric SMILES C1=C(C(=O)NC=C1C(F)(F)F)Br
Molecular Weight 242
Reaxy-Rn 13195465
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13195465&ln=

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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassPyridines and derivatives
SubclassHydropyridines
Intermediate Tree Nodes Not available
Direct ParentPyridinones
Alternative Parents Dihydropyridines  Aryl bromides  Heteroaromatic compounds  Lactams  Azacyclic compounds  Organooxygen compounds  Organonitrogen compounds  Organofluorides  Organobromides  Organic oxides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Dihydropyridine - Pyridinone - Aryl bromide - Aryl halide - Heteroaromatic compound - Lactam - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as pyridinones. These are compounds containing a pyridine ring, which bears a ketone.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Mechanisms of Action
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.

3 results found

Lot NumberCertificate TypeDateItem
F2301643Certificate of AnalysisMar 16, 2026 B186456
E2007138Certificate of AnalysisNov 10, 2025 B186456
L2214864Certificate of AnalysisSep 17, 2025 B186456
Chemical and Physical Properties
Molecular Weight241.990 g/mol
XLogP31.500
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass240.935 Da
Monoisotopic Mass240.935 Da
Topological Polar Surface Area29.100 Ų
Heavy Atom Count12
Formal Charge0
Complexity279.000
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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