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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-chloro-2-methylpyrimidine-5-carboxylic acid

Cc1ncc(c(n1)Cl)C(=O)O Request for Quotation
Chemical Name: 4-chloro-2-methylpyrimidine-5-carboxylic acid
CAS Number: 933702-81-9
Product Number: AG0036TA(AGN-PC-03UNB4)
Synonyms:
MDL No:
Molecular Formula: C6H5ClN2O2
Molecular Weight: 172.5691

Identification/Properties

Properties
Storage:
Inert atmosphere;2-8℃;
Computed Properties
Molecular Weight:
172.568g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
172.004g/mol
Monoisotopic Mass:
172.004g/mol
Topological Polar Surface Area:
63.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
165
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


The 4-Chloro-2-methylpyrimidine-5-carboxylic acid is a versatile compound widely used in chemical synthesis processes. This compound plays a crucial role in several reactions due to its unique structure and reactivity. It serves as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and fine chemicals. The presence of the chloro and carboxylic acid functional groups allows for facile derivatization and further modification, making it a valuable building block in organic synthesis. In addition, its pyrimidine ring structure imparts specific properties to the final products, making it a preferred choice in the development of novel compounds with diverse applications in the field of medicinal chemistry and material science. The 4-Chloro-2-methylpyrimidine-5-carboxylic acid is a vital component in the toolbox of synthetic chemists for creating complex molecules with tailored functionalities.