1-methyl-3-(pyridin-4-yl)-1H-pyrazole-4-carbaldehyde


Chemical Name: 1-methyl-3-(pyridin-4-yl)-1H-pyrazole-4-carbaldehyde
CAS Number: 1152546-66-1
Product Number: AG018SA3(AGN-PC-0WAKWD)
Synonyms:
MDL No:
Molecular Formula: C10H9N3O
Molecular Weight: 187.1980

Identification/Properties


Computed Properties
Molecular Weight:
187.202g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
187.075g/mol
Monoisotopic Mass:
187.075g/mol
Topological Polar Surface Area:
47.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
204
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



1-Methyl-3-(pyridin-4-yl)-1H-pyrazole-4-carbaldehyde is a versatile compound frequently employed in chemical synthesis as a key building block. Its unique structure and reactivity make it ideal for use in various organic transformations and reactions to create complex molecules for pharmaceutical, agrochemical, and material science applications. This compound can serve as a valuable intermediate in the synthesis of heterocyclic compounds, which are essential in drug discovery and development. Additionally, 1-Methyl-3-(pyridin-4-yl)-1H-pyrazole-4-carbaldehyde has shown promising results in the construction of molecular frameworks with potential biological activity, making it a valuable tool for researchers and chemists working in the field of organic synthesis.