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2-(methylsulfanyl)pyrimidine-5-carbaldehyde - 97%, high purity , CAS No.90905-31-0

COA

Grade & Purity:

≥97%

Cas Number: 90905-31-0
Molecular Weight: 154.19
PubChem CID: 3151865
PubChem SID: 488194319

In stock

Item Number

M178139

Grouped product items
SKU	Size	Availability	Price
M178139-50mg	50mg	2	$9.90
M178139-250mg	250mg	2	$31.90
M178139-1g	1g	5	$85.90
M178139-5g	5g	2	$423.90

Discover 2-(methylsulfanyl)pyrimidine-5-carbaldehyde by Aladdin Scientific in 97% for only $9.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-(Methylthio)pyrimidine-5-carbaldehyde \| 90905-31-0 \| 2-Methylsulfanyl-pyrimidine-5-carbaldehyde \| 2-methylsulfanylpyrimidine-5-carbaldehyde \| 2-(methylsulfanyl)pyrimidine-5-carbaldehyde \| 2-(METHYLTHIO)-5-PYRIMIDINECARBALDEHYDE \| MFCD03780729 \| 5-PYRIMIDINECARBOXALDE
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organosulfur compounds
  - Class Thioethers
    - Subclass Aryl thioethers

Kingdom	Organic compounds
Superclass	Organosulfur compounds
Class	Thioethers
Subclass	Aryl thioethers
Intermediate Tree Nodes	Not available
Direct Parent	Aryl thioethers
Alternative Parents	Aryl-aldehydes Alkylarylthioethers Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Aryl thioether - Aryl-aldehyde - Alkylarylthioether - Pyrimidine - Heteroaromatic compound - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Organic oxide - Aldehyde - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl 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	488194319
IUPAC Name	2-methylsulfanylpyrimidine-5-carbaldehyde
INCHI	InChI=1S/C6H6N2OS/c1-10-6-7-2-5(4-9)3-8-6/h2-4H,1H3
InChIKey	OERITKQWELOJBM-UHFFFAOYSA-N
Smiles	CSC1=NC=C(C=N1)C=O
Isomeric SMILES	CSC1=NC=C(C=N1)C=O
Molecular Weight	154.19
Reaxy-Rn	3602544
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3602544&ln=

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

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

Analytical Chart:

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12 results found

Lot Number	Certificate Type	Date	Item
A2331195	Certificate of Analysis	Apr 17, 2025	M178139
K2228364	Certificate of Analysis	Mar 10, 2025	M178139
K2228348	Certificate of Analysis	Sep 14, 2024	M178139
K2228347	Certificate of Analysis	Sep 14, 2024	M178139
K2228357	Certificate of Analysis	Sep 14, 2024	M178139
K2228358	Certificate of Analysis	Sep 14, 2024	M178139
K2228367	Certificate of Analysis	Sep 14, 2024	M178139
K2228368	Certificate of Analysis	Sep 14, 2024	M178139
K2228369	Certificate of Analysis	Sep 14, 2024	M178139
D2102142	Certificate of Analysis	Jan 13, 2023	M178139
D2102139	Certificate of Analysis	Jan 13, 2023	M178139
D2102141	Certificate of Analysis	Jan 13, 2023	M178139

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Chemical and Physical Properties

Molecular Weight	154.190 g/mol
XLogP3	0.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	154.02 Da
Monoisotopic Mass	154.02 Da
Topological Polar Surface Area	68.200 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	112.000
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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