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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

4-Pyrimidinecarboxylic acid, 2-(methylthio)-

CSc1nccc(n1)C(=O)O Request for Quotation
Chemical Name: 4-Pyrimidinecarboxylic acid, 2-(methylthio)-
CAS Number: 1126-44-9
Product Number: AG0038YU(AGN-PC-0JPET8)
Synonyms:
MDL No:
Molecular Formula: C6H6N2O2S
Molecular Weight: 170.1890

Identification/Properties

Computed Properties
Molecular Weight:
170.186g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
170.015g/mol
Monoisotopic Mass:
170.015g/mol
Topological Polar Surface Area:
88.4A^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

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-Methylsulfanylpyrimidine-4-carboxylic acid, commonly referred to as $name$, is a versatile and valuable compound in chemical synthesis. This compound serves as a crucial building block in the construction of various complex organic molecules, making it indispensable in the realm of synthetic chemistry.One key application of 2-Methylsulfanylpyrimidine-4-carboxylic acid is its use as a precursor in the synthesis of pharmaceutical compounds. Due to its unique structural properties, this compound can be modified and functionalized to introduce specific reactive groups or stereochemical features required for drug development. By incorporating 2-Methylsulfanylpyrimidine-4-carboxylic acid into the chemical synthesis process, chemists can efficiently access a wide range of bioactive molecules with therapeutic potential.Furthermore, this compound plays a crucial role in the preparation of agrochemicals and specialty chemicals. Its ability to undergo diverse chemical transformations enables the efficient production of pesticides, herbicides, and other agricultural chemicals. Additionally, 2-Methylsulfanylpyrimidine-4-carboxylic acid can be utilized in the synthesis of advanced materials, such as liquid crystals, dyes, and polymers, highlighting its significance in material science and industrial applications.Overall, 2-Methylsulfanylpyrimidine-4-carboxylic acid stands out as a versatile intermediate in chemical synthesis, enabling the creation of complex molecules across various sectors, including pharmaceuticals, agrochemicals, and materials science. Its exceptional reactivity and structural diversity make it a valuable tool for chemists striving to develop innovative compounds with diverse applications.