5-Thiazolecarboxylicacid, 2-amino-4-(trifluoromethyl)-


Chemical Name: 5-Thiazolecarboxylicacid, 2-amino-4-(trifluoromethyl)-
CAS Number: 239135-55-8
Product Number: AG003GEB(AGN-PC-0KK7H5)
Synonyms:
MDL No: MFCD00269431
Molecular Formula: C5H3F3N2O2S
Molecular Weight: 212.1497

Identification/Properties


Properties
MP:
232-236 °C (dec.)(lit.)
BP:
368.9 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
212.146g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
1
Exact Mass:
211.987g/mol
Monoisotopic Mass:
211.987g/mol
Topological Polar Surface Area:
104A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
222
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Amino-4-(trifluoromethyl)thiazole-5-carboxylic Acid, a versatile compound in chemical synthesis, serves as a crucial intermediate in the preparation of pharmaceuticals, agrochemicals, and materials with unique properties. Its functional groups make it an ideal building block for the synthesis of complex organic molecules, imparting desired biological or physical properties. Specifically, this compound is employed in the development of novel drug candidates due to its ability to modify molecular structures to enhance pharmacological activity or improve bioavailability. In agrochemical research, it plays a key role in designing crop protection agents with improved efficacy and reduced environmental impact. Additionally, in materials science, its incorporation into polymers or catalysts leads to materials with enhanced performance characteristics. The strategic utilization of 2-Amino-4-(trifluoromethyl)thiazole-5-carboxylic Acid in chemical synthesis demonstrates its significance in advancing various fields of science and technology.