2-(dimethylamino)pyrimidine-4-carboxylic acid


Chemical Name: 2-(dimethylamino)pyrimidine-4-carboxylic acid
CAS Number: 933759-45-6
Product Number: AG006G7D(AGN-PC-04RZIG)
Synonyms:
MDL No:
Molecular Formula: C7H9N3O2
Molecular Weight: 167.1653

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
167.168g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
167.069g/mol
Monoisotopic Mass:
167.069g/mol
Topological Polar Surface Area:
66.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
172
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-(Dimethylamino)pyrimidine-4-carboxylic acid is a versatile compound widely utilized in chemical synthesis as a key building block for various organic reactions. Its unique structure enables it to participate in a range of transformations, making it an essential reagent in modern organic chemistry. When employed in synthesis, this compound serves as an important intermediate in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. Its presence in the reaction mixture allows for the introduction of the dimethylamino and carboxylic acid functional groups into target molecules, enabling the formation of complex structures with specific properties. Furthermore, 2-(Dimethylamino)pyrimidine-4-carboxylic acid exhibits excellent reactivity and selectivity, making it a valuable tool for chemists seeking to construct challenging molecular architectures efficiently and reliably.