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Benzotrifluoride

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Identification
Molecular formula
C7H5F3
CAS number
98-08-8
IUPAC name
trifluoromethylbenzene
State
State

This compound is in a liquid state at room temperature. It is typically stored in sealed containers to prevent evaporation and exposure to air, as it can release vapors.

Melting point (Celsius)
-29.60
Melting point (Kelvin)
243.55
Boiling point (Celsius)
103.30
Boiling point (Kelvin)
376.45
General information
Molecular weight
146.12g/mol
Molar mass
146.1250g/mol
Density
1.2750g/cm3
Appearence

Benzotrifluoride is a colorless liquid with a distinct aromatic odor. It is clear and does not have any visible impurities under normal conditions.

Comment on solubility

Solubility of Trifluoromethylbenzene

Trifluoromethylbenzene, with the chemical formula C7H4F3, exhibits interesting solubility characteristics due to its unique structure. The presence of three fluorine atoms significantly influences its interactions with solvents.

Key Points on Solubility:

  • Nonpolar Nature: Trifluoromethylbenzene is primarily a nonpolar compound, which makes it less soluble in polar solvents like water.
  • Solvent Compatibility: It has a higher solubility in nonpolar organic solvents such as hexane and toluene, which are favored for dissolving hydrocarbons.
  • Hydrophobic Interactions: TheCF3 group contributes to hydrophobic interactions, further diminishing solubility in aqueous environments.
  • Practical Applications: Its solubility profile is useful in various chemical reactions and industrial applications, particularly in materials science and organic synthesis.

To summarize, trifluoromethylbenzene is insoluble in water but is readily soluble in nonpolar solvents. This characteristic is essential when considering its applications and behavior in chemical processes. Understanding the solubility of such compounds can greatly enhance their functional use in research and industry.

Interesting facts

Exciting Facts About Trifluoromethylbenzene

Trifluoromethylbenzene, also known as 1,1,1-trifluorotoluene, is an intriguing compound that combines the reactivity of the trifluoromethyl group with the aromatic stability of benzene. This unique structure offers a variety of fascinating properties and applications.

Chemical Characteristics

  • Reactivity: The trifluoromethyl group (-CF3) is highly electronegative, which significantly influences the chemical behavior of the entire molecule.
  • Functionality: It serves as a versatile building block in organic synthesis, aiding in the production of pharmaceuticals, agrochemicals, and other functional materials.
  • Polarity: The molecular structure lends itself to interesting polarity characteristics, making it an excellent candidate for various chemical reactions.

Applications

Trifluoromethylbenzene is not only a subject of academic interest but also plays practical roles in industry:

  • Medicinal Chemistry: Its derivative compounds are involved in the synthesis of several drugs, showing enhanced bioactivity and stability.
  • Agricultural Products: Used as an intermediate in the development of pesticides, contributing to improved efficacy in crop protection.
  • Material Science: Acts as an important solvent and enhances the performance of polymers by adding specific properties.

Interesting Insights

As a chemist, one of the most captivating aspects of trifluoromethylbenzene is the way it demonstrates the balance between stability and reactivity. It is often highlighted in research for its ability to:

  • Influence Reaction Pathways: The presence of the trifluoromethyl group often shifts reaction equilibria, enabling pathways that would otherwise be unfavorable.
  • Enhance Selectivity: This compound is known for the ability to selectively modify products in chemical reactions, which is essential in the field of asymmetric synthesis.

Overall, trifluoromethylbenzene is a compound that beautifully marries the realms of theoretical and practical chemistry, making it an invaluable subject of study within both academia and industry.

Synonyms
BENZOTRIFLUORIDE
98-08-8
(Trifluoromethyl)benzene
Trifluoromethylbenzene
alpha,alpha,alpha-Trifluorotoluene
Benzene, (trifluoromethyl)-
Phenylfluoroform
Benzylidyne fluoride
Benzenyl fluoride
a,a,a-Trifluorotoluene
USAF MA-16
Toluene trifluoride
PhCF3
NSC 8038
CF3Ph
Trifluoromethyl-benzene
UN2338
CCRIS 2808
Trifluoro(phenyl)methane
HSDB 2077
EINECS 202-635-0
Toluene, alpha,alpha,alpha-trifluoro-
C6H5CF3
BRN 1906908
omega-Trifluorotoluene
DTXSID2024589
CHEBI:36810
AI3-14870
UNII-49R6421K89
NSC-8038
Toluene, .alpha.,.alpha.,.alpha.-trifluoro-
BENZOTRIFLUORIDE [MI]
.alpha.,.alpha.,.alpha.-Trifluorotoluene
DTXCID404589
49R6421K89
4-05-00-00802 (Beilstein Handbook Reference)
TOLUENE, .ALPHA.-TRIFLUORO-
1',1',1'-TRIFLUOROTOLUENE
UN 2338
UN-2338
(1,1',1''-TRIFLUOROMETHYL)BENZENE
(trifluoromethyl)-benzene
MFCD00000372
trifluortoluol
trifluoro-toluene
aaa-Trifluorotoluene
PHENYFLUOROFORM
trifluoromethyl benzene
OPHENYLFLUOROFORM
4-trifluoromethylbenzene
trifluoro methyl benzene
WLN: FXFFR
.omega.-Trifluorotoluene
Benzene, (trifluoromethyl)
SCHEMBL8692
CHEMBL15897
alpha,alpha,alphatrifluorotoluene
.alpha.,.alpha.-Trifluorotoluene
alpha,alpha.alpha-trifluorotoluene
NSC8038
TOLUENE, ALPHA-TRIFLUORO-
Toluene, alpha,alpha,alphatrifluoro
alpha, alpha, alpha-trifluorotoluene
Tox21_200954
STL453680
AKOS000120183
CAS-98-08-8
alpha , alpha , alpha -Trifluorotoluene
NCGC00091831-01
NCGC00091831-02
NCGC00258507-01
PS-11886
alpha,alpha,alpha-Trifluorotoluene, >=99%
NS00041193
T0439
EN300-19414
Benzotrifluoride [UN2338] [Flammable liquid]
A845805
Q409755
alpha,alpha,alpha-Trifluorotoluene, anhydrous, >=99%
F0001-2313
Z104473746
alpha,alpha,alpha-Trifluorotoluene 2000 microg/mL in Methanol