2-Pyridinecarboxylic acid, 3-chloro-5-(trifluoromethyl)-


Chemical Name: 2-Pyridinecarboxylic acid, 3-chloro-5-(trifluoromethyl)-
CAS Number: 80194-68-9
Product Number: AG0036M8(AGN-PC-0KLPJH)
Synonyms:
MDL No: MFCD00277482
Molecular Formula: C7H3ClF3NO2
Molecular Weight: 225.5524

Identification/Properties


Properties
MP:
141-143 °C
BP:
308.7°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
225.551g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
224.98g/mol
Monoisotopic Mass:
224.98g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
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-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



3-Chloro-5-(Trifluoromethyl)pyridine-2-Carboxylic Acid is a versatile compound widely used in chemical synthesis due to its unique properties. In organic chemistry, this compound serves as a key building block in the formation of various heterocyclic compounds, offering a diverse range of applications in pharmaceuticals, agrochemicals, and materials science.One major application of 3-Chloro-5-(Trifluoromethyl)pyridine-2-Carboxylic Acid is as a precursor in the synthesis of pharmaceuticals. By utilizing its functional groups and reactivity, chemists can introduce specific functionalities into drug molecules, enhancing their biological activity and improving their pharmacokinetic properties. This compound is particularly valuable in the development of new medications targeting various diseases and conditions.Additionally, 3-Chloro-5-(Trifluoromethyl)pyridine-2-Carboxylic Acid plays a crucial role in agrochemical synthesis. Its incorporation into pesticide and herbicide formulations allows for the creation of more efficient and environmentally friendly agricultural products. The compound's chemical structure can be fine-tuned to optimize the performance of these agrochemicals, leading to increased crop yields and pest control.Furthermore, in materials science, 3-Chloro-5-(Trifluoromethyl)pyridine-2-Carboxylic Acid is utilized in the production of advanced materials such as polymers, dyes, and catalysts. Its unique properties make it a valuable component in the development of high-performance materials with tailored properties for specific industrial applications. By leveraging the versatility of this compound, researchers can engineer novel materials with enhanced durability, stability, and functionality.Overall, 3-Chloro-5-(Trifluoromethyl)pyridine-2-Carboxylic Acid is a versatile and indispensable compound in chemical synthesis, offering endless possibilities for innovation and advancement in various fields of science and industry.