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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)-

2-Thiazolecarboxylicacid, 4-(trifluoromethyl)-

OC(=O)c1scc(n1)C(F)(F)F Request for Quotation
Chemical Name: 2-Thiazolecarboxylicacid, 4-(trifluoromethyl)-
CAS Number: 944900-55-4
Product Number: AG003KC0(AGN-PC-01ZKRP)
Synonyms:
MDL No: MFCD07377490
Molecular Formula: C5H2F3NO2S
Molecular Weight: 197.1351

Identification/Properties

Properties
BP:
294.305 °C at 760 mmHg
Storage:
2-8℃;Keep in dry area;
Computed Properties
Molecular Weight:
197.131g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
1
Exact Mass:
196.976g/mol
Monoisotopic Mass:
196.976g/mol
Topological Polar Surface Area:
78.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
196
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


4-(Trifluoromethyl)thiazole-2-carboxylic acid is a versatile compound widely utilized in chemical synthesis due to its unique properties and reactivity. This specialized acid serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and materials. When employed in chemical reactions, it functions as a valuable intermediate, allowing for the incorporation of the trifluoromethyl and thiazole functionalities into the desired molecules. Its presence enhances the compound's biological activity, stability, and other desirable characteristics, making it highly sought after in the synthesis of numerous complex organic compounds. Additionally, the trifluoromethyl group contributes to the compound's lipophilicity and metabolic stability, further expanding its utility in drug discovery and development.