1H-Pyrazolo[4,3-d]pyrimidine, 7-chloro-1-methyl-


Chemical Name: 1H-Pyrazolo[4,3-d]pyrimidine, 7-chloro-1-methyl-
CAS Number: 923282-39-7
Product Number: AG0038JE(AGN-PC-078TOG)
Synonyms:
MDL No:
Molecular Formula: C6H5ClN4
Molecular Weight: 168.5837

Identification/Properties


Computed Properties
Molecular Weight:
168.584g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
168.02g/mol
Monoisotopic Mass:
168.02g/mol
Topological Polar Surface Area:
43.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
154
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



7-Chloro-1-methyl-1H-pyrazolo[4,3-d]pyrimidine is a versatile compound that finds widespread applications in chemical synthesis processes. This specific molecule serves as a valuable building block for the creation of various organic compounds due to its unique structure and reactivity. In chemical synthesis, 7-Chloro-1-methyl-1H-pyrazolo[4,3-d]pyrimidine acts as a key intermediate for the production of pharmaceuticals, agrochemicals, and materials with specific properties. Its incorporation into molecular structures can lead to the creation of new compounds with diverse functionalities and applications in different industries. Additionally, the presence of the chloro and methyl groups in this molecule offers opportunities for further derivatization and modification to tailor its properties for specific synthetic pathways.