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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-Oxazolecarboxylic acid, 2-chloro-4-(trifluoromethyl)-, ethyl ester

CCOC(=O)c1oc(nc1C(F)(F)F)Cl Request for Quotation
Chemical Name: 5-Oxazolecarboxylic acid, 2-chloro-4-(trifluoromethyl)-, ethyl ester
CAS Number: 78451-14-6
Product Number: AG00539U(AGN-PC-0NK9N5)
Synonyms:
MDL No:
Molecular Formula: C7H5ClF3NO3
Molecular Weight: 243.5677

Identification/Properties

Properties
BP:
280.734°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
243.566g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
3
Exact Mass:
242.991g/mol
Monoisotopic Mass:
242.991g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
248
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 2-chloro-4-(trifluoromethyl)oxazole-5-carboxylate is a versatile compound widely utilized in chemical synthesis due to its unique structure and properties. This compound serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and specialty chemicals.In chemical synthesis, Ethyl 2-chloro-4-(trifluoromethyl)oxazole-5-carboxylate can be employed as a key intermediate in the preparation of complex molecules. Its functional groups allow for selective modifications, enabling chemists to introduce specific substituents or react with various reagents to generate diverse derivatives. Additionally, the trifluoromethyl group confers desirable physicochemical properties to the resulting compounds, such as increased lipophilicity and metabolic stability, which are crucial for drug discovery and development.Furthermore, this compound can participate in a range of organic reactions, including nucleophilic substitutions, condensations, and cycloadditions, facilitating the construction of structurally intricate molecules with high efficiency and selectivity. Its versatile reactivity and compatibility with different synthetic methodologies make it a valuable tool for chemists engaged in the design and optimization of novel compounds for various applications.Overall, Ethyl 2-chloro-4-(trifluoromethyl)oxazole-5-carboxylate plays a crucial role in chemical synthesis by enabling the efficient and controlled assembly of complex molecules with diverse functionalities, making it an indispensable component in the toolkit of synthetic chemists.