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2-Methyl-4-nitropyridine N-Oxide - 98%, high purity , CAS No.5470-66-6

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2-Methyl-4-nitropyridine N-Oxide - 98%, high purity , CAS No.5470-66-6

COA

Grade & Purity:

≥98%

Cas Number: 5470-66-6
Molecular Weight: 154.12
Beilstein Registry Number: 20(5)5,503
MDL number: MFCD00014625
PubChem CID: 95291
PubChem SID: 488186895

In stock

Item Number

M103046

Grouped product items
SKU	Size	Availability	Price
M103046-1g	1g	8	$15.90
M103046-5g	5g	10	$58.90
M103046-25g	25g	4	$223.90
M103046-100g	100g	2	$803.90

View related series

Pyridines (1259) Six-Membered Heterocyclic Compounds (1696)

Basic Description

Synonyms	(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid \| 2-Methyl-4-nitropyridine N-oxide, 97% \| FT-0619191 \| 2-Picoline, 4-nitro-, 1-oxide \| 4-nitro-2-methyl pyridine N-oxide \| 4-nitro 2-picoline-N-oxide \| W-20306
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic 1,3-dipolar compounds
  - Class Allyl-type 1,3-dipolar organic compounds
    - Subclass Organic nitro compounds
      - Level5 C-nitro compounds
        Level6 Nitroaromatic compounds

Kingdom	Organic compounds
Superclass	Organic 1,3-dipolar compounds
Class	Allyl-type 1,3-dipolar organic compounds
Subclass	Organic nitro compounds
Intermediate Tree Nodes	C-nitro compounds
Direct Parent	Nitroaromatic compounds
Alternative Parents	Methylpyridines Pyridinium derivatives Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Nitroaromatic compound - Methylpyridine - Pyridine - Pyridinium - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic 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(non-human)

Plasmodium berghei (192651 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	488186895
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488186895
IUPAC Name	2-methyl-4-nitro-1-oxidopyridin-1-ium
INCHI	InChI=1S/C6H6N2O3/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4H,1H3
InChIKey	FTTIAVRPJGCXAC-UHFFFAOYSA-N
Smiles	CC1=[N+](C=CC(=C1)[N+](=O)[O-])[O-]
Isomeric SMILES	CC1=[N+](C=CC(=C1)[N+](=O)[O-])[O-]
WGK Germany	3
RTECS	UT5710000
Molecular Weight	154.12
Beilstein	20(5)5,503
Reaxy-Rn	135501
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=135501&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.

5 results found

Lot Number	Certificate Type	Date	Item
E1211052	Certificate of Analysis	Mar 14, 2024	M103046
A2402418	Certificate of Analysis	Nov 24, 2023	M103046
A2402427	Certificate of Analysis	Nov 24, 2023	M103046
D2318180	Certificate of Analysis	Apr 28, 2023	M103046
D2318173	Certificate of Analysis	Apr 26, 2023	M103046

Chemical and Physical Properties

Melt Point(°C)	155-159°C
Molecular Weight	154.120 g/mol
XLogP3	0.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	154.038 Da
Monoisotopic Mass	154.038 Da
Topological Polar Surface Area	71.300 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	156.000
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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