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HomeProduct name listBenzotrifluoride

Benzotrifluoride

Synonym(s):Benzotrifluoride

  • CAS NO.:98-08-8
  • Empirical Formula: C7H5F3
  • Molecular Weight: 146.11
  • MDL number: MFCD00000372
  • EINECS: 202-635-0
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-10-31 13:32:20
Benzotrifluoride Structural

What is Benzotrifluoride?

Chemical properties

Benzotrifluoride is a colorless to light yellow liquid, low viscosity liquid. Its polarity is intermediate between those of dichloromethane and ethyl acetate, and it is miscible with common organic solvents and able to dissolve many organic compounds. Benzotrifluoride is used in a wide variety of reactions including radical reactions, oxidations and reductions, phase-transfer reactions, transition metal catalyzed processes andLewis acid reactions.

The Uses of Benzotrifluoride

Benzotrifluoride is a useful alternative solvent for organic reactions currently conducted in dichloromethane and related solvents.

The Uses of Benzotrifluoride

In dye chemistry; in the manufacture of substituted benzotrifluorides contg an ethylenic group, used in high polymer chemistry; in dielectric fluids, such as transformer oils.

The Uses of Benzotrifluoride

It is applied as an alternative solvent to dichloromethane, where it has a higher bp. It is used as an intermediate for dyes and pharmaceuticals, as a solvent and a dielectric fluid, a vulcanizing agent.

What are the applications of Application

α,α,α-Trifluorotoluene is an alternative solvent to dichloromethane

Definition

ChEBI: (trifluoromethyl)benzene is a fluorohydrocarbon that is fluoroform in which the hydrogen is substituted by a phenyl group. It has a role as a solvent and an environmental contaminant. It is a fluorohydrocarbon and a member of (trifluoromethyl)benzenes. It derives from a fluoroform.

Synthesis Reference(s)

Synthesis, p. 932, 1980 DOI: 10.1055/s-1980-29276

General Description

A clear colorless liquid with an aromatic odor. Flash point of 54°F. Vapors are heavier than air. Insoluble in water and slightly denser than water. May be toxic by inhalation.

Air & Water Reactions

Highly flammable. Insoluble in water.

Reactivity Profile

Benzotrifluoride may react with oxidizing materials, strong bases and reducing agents.

Hazard

Highly toxic by inhalation. Flammable, dangerous fire risk.

Health Hazard

Inhalation or contact with material may irritate or burn skin and eyes. Fire may produce irritating, corrosive and/or toxic gases. Vapors may cause dizziness or suffocation. Runoff from fire control may cause pollution.

Fire Hazard

HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames. Vapors may form explosive mixtures with air. Vapors may travel to source of ignition and flash back. Most vapors are heavier than air. They will spread along ground and collect in low or confined areas (sewers, basements, tanks). Vapor explosion hazard indoors, outdoors or in sewers. Runoff to sewer may create fire or explosion hazard. Containers may explode when heated. Many liquids are lighter than water.

Flammability and Explosibility

Not classified

Safety Profile

Poison by intraperitoneal route.Moderately toxic by subcutaneous route. Dangerous fire hazard. To fight fire, usewater, foam, CO2, spray mist, dry chemical. When heatedto decomposition it emits toxic fumes of F??. Incompatiblewith oxidizing materials

Purification Methods

Purify benzotrifluoride by repeated treatment with boiling aqueous Na2CO3 (until no test for chloride ion is obtained), dry it with K2CO3, then with P2O5, and fractionally distil it. [Beilstein 5 IV 802.]

Properties of Benzotrifluoride

Melting point: −29 °C(lit.)
Boiling point: 102 °C(lit.)
Density  1.19 g/mL at 20 °C(lit.)
vapor density  5.04
vapor pressure  53 hPa (25 °C)
refractive index  n20/D 1.414(lit.)
Flash point: 54 °F
storage temp.  Store below +30°C.
solubility  0.45g/l Hydrolysis
form  Liquid
color  Clear colorless
Specific Gravity 1.199
Odor aromatic odor
explosive limit 1.4-9.3%(V)
Water Solubility  <0.1 g/100 mL at 21 ºC
Merck  14,1110
BRN  1906908
Exposure limits ACGIH: TWA 2.5 mg/m3
NIOSH: IDLH 250 mg/m3
Dielectric constant 39.0(20℃)
Stability: Stable. Highly flammable. Incompatible with strong oxidizing agents, strong bases, strong reducing agents.
CAS DataBase Reference 98-08-8(CAS DataBase Reference)
NIST Chemistry Reference Benzene, (trifluoromethyl)-(98-08-8)
EPA Substance Registry System Benzotrifluoride (98-08-8)

Safety information for Benzotrifluoride

Signal word Danger
Pictogram(s)
ghs
Flame
Flammables
GHS02
ghs
Exclamation Mark
Irritant
GHS07
ghs
Health Hazard
GHS08
GHS Hazard Statements H225:Flammable liquids
H304:Aspiration hazard
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H340:Germ cell mutagenicity
H350:Carcinogenicity
H372:Specific target organ toxicity, repeated exposure
H412:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P273:Avoid release to the environment.
P331:Do NOT induce vomiting.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for Benzotrifluoride

InChIKey GETTZEONDQJALK-UHFFFAOYSA-N

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