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3-(Trifluoromethyl)benzoic acid

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Identification
Molecular formula
C8H5F3O2
CAS number
454-92-2
IUPAC name
3-(trifluoromethyl)benzoic acid
State
State

At room temperature, 3-(Trifluoromethyl)benzoic acid is in a solid state. Its crystalline nature is quite apparent due to its well-formed crystals.

Melting point (Celsius)
122.00
Melting point (Kelvin)
395.15
Boiling point (Celsius)
250.50
Boiling point (Kelvin)
523.60
General information
Molecular weight
190.12g/mol
Molar mass
190.1320g/mol
Density
1.4890g/cm3
Appearence

3-(Trifluoromethyl)benzoic acid is a white crystalline solid with a distinctive aromatic smell. It typically forms well-defined crystals and has a sharp, acidic odor due to the carboxylic group.

Comment on solubility

Solubility of 3-(Trifluoromethyl)benzoic Acid

3-(Trifluoromethyl)benzoic acid, with the chemical formula C8H5F3O2, exhibits intriguing solubility characteristics due to its unique structure and functional groups. The presence of the trifluoromethyl group (-CF3) influences its interactions with solvents, leading to the following notable solubility traits:

  • Polar Solvents: This compound is more soluble in polar solvents such as water and alcohols compared to non-polar solvents. The ability to form hydrogen bonds through the carboxylic acid (-COOH) group enhances its solubility in these environments.
  • Non-Polar Solvents: Conversely, in non-polar organic solvents like hexane, 3-(trifluoromethyl)benzoic acid shows limited solubility. The hydrophobic characteristics of the trifluoromethyl group contribute to this phenomenon.
  • Solubility Variation: The solubility of 3-(trifluoromethyl)benzoic acid varies with temperature; as temperature increases, solubility in water typically increases as well.

In summary, the solubility of 3-(trifluoromethyl)benzoic acid highlights the crucial role of molecular structure in determining the interactions with various solvents. As chemists might say, the solubility behavior of this compound is a testament to the intricate balance of hydrophobic and hydrophilic forces at play. Always consider the nature of the solvent when attempting to dissolve this interesting compound!

Interesting facts

Interesting Facts About 3-(Trifluoromethyl)benzoic Acid

3-(Trifluoromethyl)benzoic acid is a fascinating compound that has garnered significant attention in the field of chemistry and materials science due to its unique properties and applications. Below are some interesting insights into this compound:

  • Substituted Phenyl Group: The addition of the –CF3 group to the benzoic acid structure plays a crucial role in modifying the compound's chemical behavior, making it useful in various applications.
  • Acidity Changes: The presence of the trifluoromethyl group significantly enhances the acidity of the benzoic acid, resulting in interesting pKa values that are valuable for understanding the compound's reactivity.
  • Applications in Organic Synthesis: 3-(Trifluoromethyl)benzoic acid is commonly employed as a reagent in organic synthesis, often serving as a key building block for the development of pharmaceuticals and agrochemicals.
  • Role in Material Science: This compound is noted for its potential applications in the creation of advanced materials, including polymers and surface coatings, due to its unique electronic properties.
  • Biological Activity: Research indicates that 3-(trifluoromethyl)benzoic acid derivatives may possess significant biological activities, making them subjects of interest for drug discovery.

As you delve deeper into the chemistry of 3-(trifluoromethyl)benzoic acid, you may encounter the quote: “Fluorinated compounds often exhibit unique properties that are not easily found in their non-fluorinated counterparts.” This highlights the importance of fluorine substitution in tailoring the characteristics of organic molecules.

In summary, 3-(Trifluoromethyl)benzoic acid stands as a prime example of how modifications at the molecular level can lead to significant advancements in various scientific fields.

Synonyms
3-(Trifluoromethyl)benzoic acid
454-92-2
Benzoic acid, 3-(trifluoromethyl)-
3-TRIFLUOROMETHYLBENZOIC ACID
m-Trifluoromethylbenzoic acid
alpha,alpha,alpha-Trifluoro-m-toluic acid
m-(Trifluoromethyl)benzoic acid
3-Carboxybenzotrifluoride
3-Trifluoromethyl-benzoic acid
MFCD00002519
m-(trifluoroformyl)benzoic acid
DTXSID2041460
CHEBI:60695
3-TFMBA
NSC-43025
.alpha.,.alpha.,.alpha.-Trifluoro-m-toluic acid
930H336M90
DTXCID0021460
FQXQBFUUVCDIRK-UHFFFAOYSA-
TRIFLUOROMETHYL)BENZOIC ACID, M-(
m-Toluic acid, .alpha.,.alpha.,.alpha.-trifluoro-
m-CARBOXYBENZOTRIFLUORIDE
flurtamone TP2
UNII-930H336M90
EINECS 207-230-2
NSC 43025
m-Trifluorometylbenzoic acid
SCHEMBL40186
CHEMBL66551
3-trifluoromethyl benzoic acid
meta-trifluoromethylbenzoic acid
meta-trifluoromethyl benzoic acid
3-(trifluoromethyl) benzoic acid
3-(trifluoromethyl)-benzoic acid
VVPCVJJLCKEWSL-UHFFFAOYSA-N
ALBB-022842
NSC43025
Tox21_300654
STK946189
AKOS000118820
3-(Trifluoromethyl)benzoic acid, 99%
AC-2637
CS-W009200
PS-8388
NCGC00248130-01
NCGC00254562-01
CAS-454-92-2
SY002359
alpha,alpha,alpha-Tri-fluoro-m-toluic acid
Benzoic acid, 3-(trifluoromethyl)-(9CI)
m-Toluic acid,.alpha.,.alpha.-trifluoro-
DB-024071
m-Toluic acid, alpha,alpha,alpha-trifluoro-
NS00080456
T1034
EN300-19506
AO-801/41077429
Q27128433
F0001-1229
Z104474066
207-230-2
3-Carboxybenzotrifluoride; m-Trifluoromethylbenzoic acid; alpha,alpha,alpha-Trifluoro-m-toluic acid