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2,4-Dimethylpyridine N-Oxide - 98%, high purity , CAS No.1122-45-8

COA

Grade & Purity:

≥98%

Cas Number: 1122-45-8
Molecular Weight: 123.16
MDL number: MFCD00094914
PubChem CID: 70733
PubChem SID: 488184581

In stock

Item Number

D404346

Grouped product items
SKU	Size	Availability	Price
D404346-250mg	250mg	3	$66.90
D404346-1g	1g	3	$219.90
D404346-5g	5g	3	$716.90

View related series

Pyridines (1259)

Basic Description

Synonyms	Pyridine, 2,4-dimethyl-, 1-oxide \| Pyridine,2,4-dimethyl-, 1-oxide \| 978DN6CD4N \| SCHEMBL501845 \| AKOS006228652 \| STL280363 \| 2,4-Lutidine-1-oxide \| E85589 \| 2,4-Dimethyl-pyridine 1-oxide \| 2,4-Dimethylpyridine 1-oxide \| 2,4-dimethyl-1-oxidopyridin-1-ium
Specifications & Purity	≥98%
Storage Temp	Argon charged
Product Description	Maximum Absorption Wavelength:262(EtOH)nm

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Methylpyridines
Intermediate Tree Nodes	Not available
Direct Parent	Methylpyridines
Alternative Parents	Pyridinium derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Methylpyridine - Pyridinium - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as methylpyridines. These are organic compounds containing a pyridine ring substituted at one or more positions by a methyl 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

Pubchem Sid	488184581
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184581
IUPAC Name	2,4-dimethyl-1-oxidopyridin-1-ium
INCHI	InChI=1S/C7H9NO/c1-6-3-4-8(9)7(2)5-6/h3-5H,1-2H3
InChIKey	KMQVCYOPBMKRKH-UHFFFAOYSA-N
Smiles	CC1=CC(=[N+](C=C1)[O-])C
Isomeric SMILES	CC1=CC(=[N+](C=C1)[O-])C
Molecular Weight	123.16
Reaxy-Rn	111337
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=111337&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.

4 results found

Lot Number	Certificate Type	Date	Item
C2309548	Certificate of Analysis	Dec 15, 2022	D404346
C2309536	Certificate of Analysis	Dec 15, 2022	D404346
C2514252	Certificate of Analysis	Dec 15, 2022	D404346
C2309549	Certificate of Analysis	Dec 15, 2022	D404346

Chemical and Physical Properties

Sensitivity	Moisture Sensitive
Refractive Index	1.57
Flash Point(°C)	129 °C
Boil Point(°C)	91 °C/0.3 mmHg
Molecular Weight	123.150 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	123.068 Da
Monoisotopic Mass	123.068 Da
Topological Polar Surface Area	25.500 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	94.900
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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