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4-Hydroxy-6-methylpyrimidine - 98%, high purity , CAS No.156647-96-0

COA

Grade & Purity:

≥98%

Cas Number: 156647-96-0
Molecular Weight: 110.11
EC Number: ‘222-543-4
PubChem CID: 135431249
PubChem SID: 504773309

In stock

Item Number

H587427

Grouped product items
SKU	Size	Availability	Price
H587427-1g	1g	2	$61.90
H587427-5g	5g	1	$113.90
H587427-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$668.90

Basic Description

Synonyms	6-Methyl-4-pyrimidinol \| 6-methyl-3,4-dihydropyrimidin-4-one \| 6-Methyl-4(3H)-pyrimidinone \| H1675 \| DTXSID2063056 \| 6-Methyl-4-oxopyrimidine \| SCHEMBL503863 \| 1849316-98-8 \| FT-0648295 \| SCHEMBL11154028 \| AKOS002363247 \| J-515770 \| NSC193523 \| NSC-193523
Specifications & Purity	≥98%
Storage Temp	Room temperature,Desiccated
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazines
    - Subclass Pyrimidines and pyrimidine derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazines
Subclass	Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Pyrimidones
Alternative Parents	Hydropyrimidines Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Pyrimidone - Hydropyrimidine - Heteroaromatic compound - Vinylogous amide - Azacycle - 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 pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
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	504773309
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504773309
IUPAC Name	4-methyl-1H-pyrimidin-6-one
INCHI	InChI=1S/C5H6N2O/c1-4-2-5(8)7-3-6-4/h2-3H,1H3,(H,6,7,8)
InChIKey	LHRIUKSRPHFASO-UHFFFAOYSA-N
Smiles	CC1=CC(=O)NC=N1
Isomeric SMILES	CC1=CC(=O)NC=N1
NSC Number	NSC Number': ['18893; 193523
Molecular Weight	110.11
Reaxy-Rn	109748
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109748&ln=

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
J2320569	Certificate of Analysis	Sep 22, 2023	H587427
J2320567	Certificate of Analysis	Sep 22, 2023	H587427
J2320570	Certificate of Analysis	Sep 22, 2023	H587427
J2320568	Certificate of Analysis	Sep 22, 2023	H587427
J2320632	Certificate of Analysis	Sep 22, 2023	H587427

Chemical and Physical Properties

Molecular Weight	110.110 g/mol
XLogP3	-0.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	110.048 Da
Monoisotopic Mass	110.048 Da
Topological Polar Surface Area	41.500 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	169.000
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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