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5-Bromo-4-hydroxynicotinic acid - 95%, high purity , CAS No.1052114-83-6

COA

Grade & Purity:

≥95%

Cas Number: 1052114-83-6
Molecular Weight: 218.00
PubChem CID: 60204208

In stock

Item Number

B586254

Grouped product items
SKU	Size	Availability	Price
B586254-100mg	100mg	3	$69.90
B586254-250mg	250mg	3	$156.90
B586254-1g	1g	3	$559.90

Basic Description

Synonyms	Y10035 \| 5-Bromo-4-hydroxypyridine-3-carboxylic acid \| 5-bromo-4-oxo-1H-pyridine-3-carboxylic acid \| SCHEMBL15334246 \| Z1269204092 \| 5-Bromo-4-hydroxynicotinic acid \| 1052114-83-6 \| AS-50217 \| MFCD11101029 \| 5-Bromo-4-hydroxynicotinicacid \| 5-Bromo-4-oxo-
Specifications & Purity	≥95%
Storage Temp	Store at 2-8°C,Protected from light,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Pyridinecarboxylic acids and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Pyridinecarboxylic acids
Alternative Parents	Dihydropyridinecarboxylic acids and derivatives Aryl bromides Vinylogous amides Heteroaromatic compounds Cyclic ketones Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Dihydropyridinecarboxylic acid derivative - Pyridine carboxylic acid - Dihydropyridine - Aryl bromide - Aryl halide - Hydropyridine - Heteroaromatic compound - Vinylogous amide - Cyclic ketone - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
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	5-bromo-4-oxo-1H-pyridine-3-carboxylic acid
INCHI	InChI=1S/C6H4BrNO3/c7-4-2-8-1-3(5(4)9)6(10)11/h1-2H,(H,8,9)(H,10,11)
InChIKey	GZZLALVERDWLIO-UHFFFAOYSA-N
Smiles	C1=C(C(=O)C(=CN1)Br)C(=O)O
Isomeric SMILES	C1=C(C(=O)C(=CN1)Br)C(=O)O
PubChem CID	60204208
Molecular Weight	218.00

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

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

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
H2321401	Certificate of Analysis	Jul 24, 2023	B586254
H2321395	Certificate of Analysis	Jul 24, 2023	B586254
H2321390	Certificate of Analysis	Jul 24, 2023	B586254

Chemical and Physical Properties

Sensitivity	light sensitive
Molecular Weight	218.000 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	216.937 Da
Monoisotopic Mass	216.937 Da
Topological Polar Surface Area	66.400 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	280.000
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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