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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)-

3-methyl-1,2,4-oxadiazole-5-carboxylic acid

Cc1nc(on1)C(=O)O Request for Quotation
Chemical Name: 3-methyl-1,2,4-oxadiazole-5-carboxylic acid
CAS Number: 944906-32-5
Product Number: AG00IIAC(AGN-PC-03CCHX)
Synonyms:
MDL No: MFCD10000816
Molecular Formula: C4H4N2O3
Molecular Weight: 128.0862

Identification/Properties

Computed Properties
Molecular Weight:
128.087g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
128.022g/mol
Monoisotopic Mass:
128.022g/mol
Topological Polar Surface Area:
76.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
127
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


3-Methyl-1,2,4-oxadiazole-5-carboxylic acid is a versatile compound that plays a crucial role in chemical synthesis. It is widely utilized as a building block in the production of various pharmaceuticals, agrochemicals, and functional materials. The presence of the oxadiazole ring in its structure imparts unique properties, making it valuable in the creation of novel chemical entities with diverse applications.In chemical synthesis, this compound serves as a key intermediate in the preparation of biologically active molecules. Its functional groups allow for further derivatization, enabling the attachment of specific molecular fragments to tailor the desired properties of the final product. Additionally, the presence of the carboxylic acid group provides a versatile handle for subsequent transformations, such as amidation, esterification, or peptide coupling reactions.Furthermore, 3-Methyl-1,2,4-oxadiazole-5-carboxylic acid can participate in various multi-step synthesis routes, leading to the creation of complex organic molecules with enhanced biological or chemical activities. Its ability to act as a key structural element in drug design makes it a valuable tool for medicinal chemists seeking to develop new therapeutic agents with improved efficacy and reduced side effects.Overall, the application of 3-Methyl-1,2,4-oxadiazole-5-carboxylic acid in chemical synthesis facilitates the efficient and strategic production of diverse compounds with potential applications in pharmaceuticals, agriculture, and material science. Its versatility and reactivity make it a valuable building block for the synthesis of advanced molecules with tailored properties and functions.