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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)-

5-Furan-2-yl-isoxazole-3-carboxylic acid

OC(=O)c1noc(c1)c1ccco1 Request for Quotation
Chemical Name: 5-Furan-2-yl-isoxazole-3-carboxylic acid
CAS Number: 98434-06-1
Product Number: AG003MS2(AGN-PC-0K0E5X)
Synonyms:
MDL No: MFCD04113954
Molecular Formula: C8H5NO4
Molecular Weight: 179.1296

Identification/Properties

Properties
MP:
151 °C
BP:
418.4°C at 760 mmHg
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
179.131g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
179.022g/mol
Monoisotopic Mass:
179.022g/mol
Topological Polar Surface Area:
76.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
208
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:
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


5-(Furan-2-yl)isoxazole-3-carboxylic acid is a versatile compound that plays a crucial role in chemical synthesis. This compound is commonly utilized as a key building block in the preparation of various pharmaceuticals, agrochemicals, and advanced materials. Its unique structural features make it an essential component in the synthesis of complex organic molecules.In chemical synthesis, 5-(Furan-2-yl)isoxazole-3-carboxylic acid serves as a valuable starting material for the construction of diverse heterocyclic compounds through various synthetic routes. Its presence in a molecule can impart specific functional properties, making it highly desirable in the design and development of new chemical entities.Furthermore, the reactivity of 5-(Furan-2-yl)isoxazole-3-carboxylic acid allows for efficient derivatization, enabling the introduction of different functional groups to tailor the properties of the final product. This flexibility opens up a wide range of possibilities for the creation of novel compounds with tailored characteristics for specific applications in the fields of medicinal chemistry, materials science, and agrochemical research.Overall, the strategic utilization of 5-(Furan-2-yl)isoxazole-3-carboxylic acid in chemical synthesis showcases its importance as a valuable intermediate that contributes to the diversity and complexity of organic molecules produced in modern synthetic chemistry practices.