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2-methyl-4H-pyrazolo[1,5-a]pyrimidin-5-one - 97%, high purity , CAS No.189116-35-6

COA

Grade & Purity:

≥97%

Cas Number: 189116-35-6
Molecular Weight: 149.15
PubChem CID: 135965023

In stock

Item Number

M630932

Grouped product items
SKU	Size	Availability	Price
M630932-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$119.90
M630932-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$485.90
M630932-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$970.90

Basic Description

Synonyms	AKOS026732408 \| MRJRGRLUNFIVEZ-UHFFFAOYSA-N \| 2-methyl-4h-pyrazolo[1,5-a]pyrimidin-5-one \| SY323098 \| 2-Methylpyrazolo[1,5-a]pyrimidin-5-ol \| SCHEMBL3345939 \| SCHEMBL7717838 \| CS-0081614 \| 2-Methylpyrazolo[1,5-a]pyrimidin-5(1H)-one \| DTXSID00625858 \| MFCD
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyrazolopyrimidines
    - Subclass Pyrazolo[1,5-a]pyrimidines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyrazolopyrimidines
Subclass	Pyrazolo[1,5-a]pyrimidines
Intermediate Tree Nodes	Not available
Direct Parent	Pyrazolo[1,5-a]pyrimidines
Alternative Parents	Pyrimidones Vinylogous amides Pyrazoles Heteroaromatic compounds Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Pyrazolo[1,5-a]pyrimidine - Pyrimidone - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Pyrazole - Azole - Lactam - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as pyrazolo[1,5-a]pyrimidines. These are aromatic heterocyclic compounds containing a pyrazolo[3,4-d]pyrimidine ring system, which consists of a pyrazole ring fused to and sharing exactly one nitrogen atom with a pyrimidine ring.
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

IUPAC Name	2-methyl-4H-pyrazolo[1,5-a]pyrimidin-5-one
INCHI	InChI=1S/C7H7N3O/c1-5-4-6-8-7(11)2-3-10(6)9-5/h2-4H,1H3,(H,8,11)
InChIKey	MRJRGRLUNFIVEZ-UHFFFAOYSA-N
Smiles	CC1=NN2C=CC(=O)NC2=C1
Isomeric SMILES	CC1=NN2C=CC(=O)NC2=C1
Alternate CAS	189116-35-6
PubChem CID	135965023
Molecular Weight	149.15

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	149.150 g/mol
XLogP3	0.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	149.059 Da
Monoisotopic Mass	149.059 Da
Topological Polar Surface Area	46.900 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	214.000
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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