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2-Hydroxy-4-(trifluoromethyl)pyridine - >98.0%(GC), high purity , CAS No.50650-59-4

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2-Hydroxy-4-(trifluoromethyl)pyridine - >98.0%(GC), high purity , CAS No.50650-59-4

COA

Grade & Purity:

≥98%(GC)

Cas Number: 50650-59-4
Molecular Weight: 163.1
MDL number: MFCD00153195
PubChem CID: 2775130
PubChem SID: 488193627

In stock

Item Number

H138925

Grouped product items
SKU	Size	Availability	Price
H138925-250mg	250mg	3	$24.90
H138925-1g	1g	8	$74.90
H138925-5g	5g	7	$240.90
H138925-25g	25g	5	$1,081.90
H138925-100g	100g	2	$3,893.90

View related series

Heterocyclic fluorine-containing block (9) Synthetic block (741)

Basic Description

Synonyms	2-Hydroxy-4-(trifluoromethyl)pyridine, 97% \| 4-(Trifluoromethyl)pyridine-2-ol \| STL555114 \| 2(1H)-Pyridinone, 4-(trifluoromethyl)- \| 4-(trifluoromethyl) pyridin-2-ol \| AB04095 \| Maybridge3_000683 \| Q-101472 \| T2790 \| VODLFQBLXUIESC-UHFFFAOYSA-N \| Q-101240
Specifications & Purity	≥98%(GC)
Storage Temp	Argon charged
Shipped In	Normal
Product Description	Product Application： 2-Hydroxy-4-(trifluoromethyl)pyridine is used in the production of agrochemicals and pharmaceuticals.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Hydropyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Hydropyridines
Intermediate Tree Nodes	Not available
Direct Parent	Pyridinones
Alternative Parents	Dihydropyridines Heteroaromatic compounds Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Dihydropyridine - Pyridinone - Heteroaromatic compound - Lactam - Azacycle - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic compound
Description	This 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
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

Pseudomonas aeruginosa (123386 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Acinetobacter baumannii (41033 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	488193627
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488193627
IUPAC Name	4-(trifluoromethyl)-1H-pyridin-2-one
INCHI	InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-10-5(11)3-4/h1-3H,(H,10,11)
InChIKey	IKHLLNMSMFVTLP-UHFFFAOYSA-N
Smiles	C1=CNC(=O)C=C1C(F)(F)F
Isomeric SMILES	C1=CNC(=O)C=C1C(F)(F)F
WGK Germany	3
Molecular Weight	163.1
Reaxy-Rn	8199155
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8199155&ln=

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.

7 results found

Lot Number	Certificate Type	Date	Item
F2413029	Certificate of Analysis	Jun 20, 2024	H138925
B2218106	Certificate of Analysis	Dec 14, 2023	H138925
B2218121	Certificate of Analysis	Dec 14, 2023	H138925
B2218101	Certificate of Analysis	Dec 14, 2023	H138925
B2218120	Certificate of Analysis	Dec 14, 2023	H138925
B2218539	Certificate of Analysis	Dec 14, 2023	H138925
D1719131	Certificate of Analysis	Nov 17, 2022	H138925

Chemical and Physical Properties

Solubility	Soluble in methanol.
Sensitivity	Air Sensitive
Melt Point(°C)	158 °C
Molecular Weight	163.100 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	163.024 Da
Monoisotopic Mass	163.024 Da
Topological Polar Surface Area	29.100 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	239.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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