1. Home
  2. Benzoic acid, 4-fluoro-3-(trifluoromethyl)-

Contact Angene

Tel: +852 8191 6999

Email: sales@angenechemical.com

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)-

Benzoic acid, 4-fluoro-3-(trifluoromethyl)-

OC(=O)c1ccc(c(c1)C(F)(F)F)F Request for Quotation
Chemical Name: Benzoic acid, 4-fluoro-3-(trifluoromethyl)-
CAS Number: 67515-55-3
Product Number: AG003LDS(AGN-PC-0JSAI8)
Synonyms:
MDL No:
Molecular Formula: C8H4F4O2
Molecular Weight: 208.1098

Identification/Properties

Properties
MP:
114-116 °C(lit.)
BP:
256.9±40.0°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
208.112g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
208.015g/mol
Monoisotopic Mass:
208.015g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
226
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

Request for Quotation

Customer Feedback

Chemical Structure


4-Fluoro-3-(trifluoromethyl)benzoic acid is a versatile compound widely used in chemical synthesis for its unique properties and reactivity. In organic synthesis, this compound serves as a valuable building block for the preparation of various pharmaceuticals, agrochemicals, and materials.One of the key applications of 4-Fluoro-3-(trifluoromethyl)benzoic acid is its use as a precursor in the synthesis of fluorinated organic compounds. The presence of a fluoro and trifluoromethyl group in its structure imparts distinctive characteristics to the final products, such as increased lipophilicity, metabolic stability, and bioactivity. These fluorinated compounds find applications in medicinal chemistry for developing novel drug candidates with improved pharmacokinetic properties.Furthermore, 4-Fluoro-3-(trifluoromethyl)benzoic acid can also be employed in transition-metal catalyzed reactions to introduce fluorine atoms into organic molecules. This fluorination process is valuable in the pharmaceutical industry for enhancing the biological activity and selectivity of drug molecules. Additionally, the trifluoromethyl group in this compound acts as a directing group in C-H activation reactions, facilitating the selective functionalization of aromatic rings.Overall, the strategic incorporation of 4-Fluoro-3-(trifluoromethyl)benzoic acid in chemical synthesis enables the efficient construction of fluorinated compounds with diverse applications in drug discovery, materials science, and agrochemical development.