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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-methyl-5-(trifluoromethyl)nicotinic acid

OC(=O)c1cc(cnc1C)C(F)(F)F Request for Quotation
Chemical Name: 2-methyl-5-(trifluoromethyl)nicotinic acid
CAS Number: 1211581-65-5
Product Number: AG009YCR(AGN-PC-0WALF5)
Synonyms:
MDL No:
Molecular Formula: C8H6F3NO2
Molecular Weight: 205.1339

Identification/Properties

Computed Properties
Molecular Weight:
205.136g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
205.035g/mol
Monoisotopic Mass:
205.035g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
229
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-Methyl-5-(trifluoromethyl)nicotinic acid, also known as $name$, is a versatile compound widely used in chemical synthesis. Its unique structure makes it a valuable building block for the production of various pharmaceuticals, agrochemicals, and specialty chemicals. Due to its trifluoromethyl group, $name$ exhibits enhanced chemical reactivity and stability, making it a highly desired reagent in organic synthesis processes.One of the key applications of 2-Methyl-5-(trifluoromethyl)nicotinic acid is its role as a precursor in the synthesis of complex molecules such as fluorinated heterocycles. The trifluoromethyl group in $name$ can be further manipulated through various functional group transformations, giving chemists the flexibility to tailor the molecule for specific reactions and biological activities. Additionally, the presence of the nicotinic acid moiety provides opportunities for further derivatization, allowing for the introduction of additional substituents or chiral centers.In medicinal chemistry, 2-Methyl-5-(trifluoromethyl)nicotinic acid has been utilized in the development of novel drug candidates with enhanced biological activities and improved pharmacokinetic profiles. Its incorporation into drug molecules has been shown to enhance metabolic stability, membrane permeability, and protein binding affinity, all of which are crucial factors in drug design and development.Furthermore, in agrochemical applications, $name$ can be utilized as a key intermediate in the synthesis of pesticides, herbicides, and fungicides. Its unique structure and fluorinated nature contribute to the biological activity and environmental stability of the final agrochemical products, making it a valuable component in the agricultural industry.Overall, 2-Methyl-5-(trifluoromethyl)nicotinic acid plays a vital role in chemical synthesis, offering chemists diverse opportunities to explore new synthetic pathways and develop innovative molecules with enhanced properties for various industrial applications.