2-(3-methylphenyl)pyrimidine-5-carbaldehyde


Chemical Name: 2-(3-methylphenyl)pyrimidine-5-carbaldehyde
CAS Number: 915921-67-4
Product Number: AG00IGRZ(AGN-PC-0WB3H2)
Synonyms:
MDL No: MFCD08059844
Molecular Formula: C12H10N2O
Molecular Weight: 198.2206

Identification/Properties


Computed Properties
Molecular Weight:
198.225g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
198.079g/mol
Monoisotopic Mass:
198.079g/mol
Topological Polar Surface Area:
42.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
212
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



2-(3-Methylphenyl)-5-pyrimidinecarboxaldehyde, also known as $name$, is a versatile compound widely utilized in chemical synthesis. This compound serves as a key building block for the creation of various advanced materials, pharmaceuticals, and agrochemicals due to its unique chemical properties.In chemical synthesis, 2-(3-Methylphenyl)-5-pyrimidinecarboxaldehyde acts as a crucial intermediate in the preparation of diverse organic compounds. It participates in numerous reactions, including condensation, reduction, and oxidation processes, to form complex molecular structures with specific functionalities. With its aromatic ring and carbonyl group, this compound serves as a valuable starting material for the synthesis of biologically active molecules, functional polymers, and specialty chemicals.Additionally, 2-(3-Methylphenyl)-5-pyrimidinecarboxaldehyde plays a vital role in the development of novel drugs, herbicides, and insecticides. By incorporating this compound into the molecular design of pharmaceuticals and agrochemicals, researchers can enhance the efficacy, selectivity, and safety profiles of the final products. Its structural features make it an essential component in the creation of potent bioactive compounds targeting various biological pathways.Overall, 2-(3-Methylphenyl)-5-pyrimidinecarboxaldehyde is a valuable tool in chemical synthesis, enabling scientists to design and produce a wide range of functional molecules with applications in pharmaceutical, agricultural, and material science industries.