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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-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxylic acid

OC(=O)c1cncc(c1)c1ccc(cc1)OC(F)(F)F Request for Quotation
Chemical Name: 5-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxylic acid
CAS Number: 898796-62-8
Product Number: AG00IFV8(AGN-PC-04Q6EN)
Synonyms:
MDL No: MFCD06410279
Molecular Formula: C13H8F3NO3
Molecular Weight: 283.2027

Identification/Properties

Computed Properties
Molecular Weight:
283.206g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
3
Exact Mass:
283.046g/mol
Monoisotopic Mass:
283.046g/mol
Topological Polar Surface Area:
59.4A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
340
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


5-(4-Trifluoromethoxyphenyl)-nicotinic acid, also known as $name$, is a versatile compound widely utilized in chemical synthesis. This compound serves as a key building block in the preparation of various organic molecules due to its unique structure and reactivity.One notable application of $name$ in chemical synthesis is its use as a precursor in the synthesis of pharmaceutical compounds. The presence of the nicotinic acid moiety in $name$ allows for the introduction of functional groups or substituents, making it an invaluable starting material for the creation of novel drug candidates. By modifying the structure of $name$ through synthetic transformations, chemists can tailor the properties of the resulting compounds to enhance their biological activity or improve their pharmacokinetic profile.Furthermore, the trifluoromethoxyphenyl group in $name$ confers additional properties such as enhanced lipophilicity and meta-directing effects in aromatic substitution reactions. This makes $name$ a valuable intermediate in the synthesis of complex organic molecules, including agrochemicals, fine chemicals, and materials.Overall, the strategic incorporation of 5-(4-Trifluoromethoxyphenyl)-nicotinic acid into chemical synthesis routes enables the efficient construction of diverse functionalized compounds with potential applications across various industries, highlighting its significance as a versatile building block in organic synthesis.