1,3,5-Triazin-2(1H)-one, 4-amino-6-methyl-


Chemical Name: 1,3,5-Triazin-2(1H)-one, 4-amino-6-methyl-
CAS Number: 16352-06-0
Product Number: AG001U6G(AGN-PC-0O4O6F)
Synonyms:
MDL No:
Molecular Formula: C4H6N4O
Molecular Weight: 126.1166

Identification/Properties


Computed Properties
Molecular Weight:
126.119g/mol
XLogP3:
-1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
126.054g/mol
Monoisotopic Mass:
126.054g/mol
Topological Polar Surface Area:
79.8A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
205
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



6-Amino-4-methyl-1,3,5-triazin-2(1H)-one, also known as atrazine, is a powerful chemical compound widely utilized in chemical synthesis applications. Its unique molecular structure makes it a valuable tool in various chemical reactions, particularly in the field of organic synthesis.One of the key applications of 6-Amino-4-methyl-1,3,5-triazin-2(1H)-one in chemical synthesis is its role as a building block in the creation of complex organic molecules. Its nitrogen-rich heterocyclic ring provides a versatile platform for the attachment of different functional groups, allowing for the synthesis of diverse chemical compounds.Furthermore, 6-Amino-4-methyl-1,3,5-triazin-2(1H)-one can act as a key intermediate in the production of herbicides and other agricultural chemicals. Its reactivity and structural characteristics make it a valuable precursor in the development of compounds that have pesticidal properties, contributing to advancements in the agricultural industry.Overall, the utilization of 6-Amino-4-methyl-1,3,5-triazin-2(1H)-one in chemical synthesis plays a crucial role in the creation of new materials, medicines, and agricultural products, highlighting its significance in the realm of organic chemistry.