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4-Methylpyridine-3-carboxylic acid - 97%, high purity , CAS No.3222-50-2

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4-Methylpyridine-3-carboxylic acid - 97%, high purity , CAS No.3222-50-2

COA

Grade & Purity:

≥97%

Cas Number: 3222-50-2
Molecular Weight: 137.14
MDL number: MFCD00128869
PubChem CID: 229163
PubChem SID: 488188800

In stock

Item Number

M169552

Grouped product items
SKU	Size	Availability	Price
M169552-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$71.90
M169552-1g	1g	9	$221.90
M169552-5g	5g	3	$996.90
M169552-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,792.90
M169552-25g	25g	4	$4,034.90

Basic Description

Synonyms	AKOS000271608 \| AM20051066 \| ZKUZSTXNVMIDCY-UHFFFAOYSA-N \| 4-methylnicotinicacid \| FT-0600278 \| MFCD00000663 \| J-506836 \| A5793 \| MFCD00128869 \| NCGC00166267-01 \| 4-methylnicotinic acid;4-Methyl-3-pyridinecarboxylic acid \| PB17119 \| SCHEMBL258230 \| TS-017
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

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	Methylpyridines Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Pyridine carboxylic acid - Methylpyridine - Heteroaromatic compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen 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

Associated Targets(Human)

POLK Tbio DNA polymerase kappa (8653 Activities)

Discover Target: POLK

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	488188800
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488188800
IUPAC Name	4-methylpyridine-3-carboxylic acid
INCHI	InChI=1S/C7H7NO2/c1-5-2-3-8-4-6(5)7(9)10/h2-4H,1H3,(H,9,10)
InChIKey	ZKUZSTXNVMIDCY-UHFFFAOYSA-N
Smiles	CC1=C(C=NC=C1)C(=O)O
Isomeric SMILES	CC1=C(C=NC=C1)C(=O)O
WGK Germany	3
Molecular Weight	137.14
Reaxy-Rn	114463
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=114463&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.

6 results found

Lot Number	Certificate Type	Date	Item
C2521503	Certificate of Analysis	Jun 25, 2024	M169552
C2521505	Certificate of Analysis	Jun 25, 2024	M169552
J1922086	Certificate of Analysis	Aug 01, 2023	M169552
L2205507	Certificate of Analysis	Dec 13, 2022	M169552
I2201782	Certificate of Analysis	Jun 10, 2022	M169552
I2201781	Certificate of Analysis	Jun 10, 2022	M169552

Chemical and Physical Properties

Melt Point(°C)	217-221°C
Molecular Weight	137.140 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	137.048 Da
Monoisotopic Mass	137.048 Da
Topological Polar Surface Area	50.200 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	136.000
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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