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6-Bromo-3-(trifluoromethyl)-[1，2，4]triazolo[4，3-a]pyridine - ≥97%, high purity , CAS No.1166819-53-9

COA

Grade & Purity:

≥97%

Cas Number: 1166819-53-9
Molecular Weight: 266.02
PubChem CID: 58118906

In stock

Item Number

B734303

Grouped product items
SKU	Size	Availability	Price
B734303-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$27.90
B734303-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$185.90
B734303-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$738.90

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Fluorine containing blocks (199)

Basic Description

Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Triazolopyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Triazolopyridines
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Triazolopyridines
Alternative Parents	Pyridines and derivatives Aryl bromides Triazoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organobromides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Triazolopyridine - Aryl bromide - Aryl halide - Pyridine - 1,2,4-triazole - Triazole - Azole - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as triazolopyridines. These are compounds containing a triazole ring fused to a pyridine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
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

Names and Identifiers

IUPAC Name	6-bromo-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
INCHI	InChI=1S/C7H3BrF3N3/c8-4-1-2-5-12-13-6(7(9,10)11)14(5)3-4/h1-3H
InChIKey	SYYNJBWDDYHXEY-UHFFFAOYSA-N
Smiles	C1=CC2=NN=C(N2C=C1Br)C(F)(F)F
Isomeric SMILES	C1=CC2=NN=C(N2C=C1Br)C(F)(F)F
Molecular Weight	266.02

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	266.020 g/mol
XLogP3	2.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	264.946 Da
Monoisotopic Mass	264.946 Da
Topological Polar Surface Area	30.200 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	223.000
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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