1-Fluoro-4-(trifluoromethyl)benzene

Basic Information

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CAS Number

402-44-8

Molecular Formula

C7H4F4

Molecular Weight

164.1 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

−42-−41.7 °C

Boiling Point

103°C

Water Solubility

Slightly soluble in water.

Refractive Index

n20/D 1.401(lit.)

SMILES

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C1=CC(=CC=C1C(F)(F)F)F

InChI

InChI=1S/C7H4F4/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H

InChIKey

UNNNAIWPDLRVRN-UHFFFAOYSA-N

LogP

2.8445

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

121

Safety Information

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GHS Hazard Pictograms

H225

H315

H319

H335

Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 3 Class 3

Synonyms & References

English

4-Flourobenzotrifluoride
Toluene, p,.alpha.,.alpha.,.alpha.-tetrafluoro-
4-trifluoromethyl-1-fluorobenzene
alpha,alpha,alpha,p-Tetrafluorotoluene
F0357
4-Fluorobenzotrifluoride, 98%
F8881-5159
alpha,alpha,alpha,4-Tetrafluorotoluene
NSC88289
1-fluoro-4-trifluoromethylbenzene
fluoro-4-(trifluoromethyl)benzene
NS00043201
EN300-64689
1-Fluoro-4-(trifluoromethyl)benzene
1-(trifluoromethyl)-4-fluorobenzene
1-fluoro-4-(trifluoromethyl)-benzene
C7H4F4
CS-W010841
p,.alpha.,.alpha.-Tetrafluorotoluene
402-44-8
p-fluoro-benzotrifluoride
InChI=1/C7H4F4/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4
FT-0618515
p-(Trifluoromethyl)fluorobenzene
4-fluorobenzo-trifluoride
1-fluoro-4-trifluoromethyl benzene
.alpha.,.alpha.,.alpha.,p-Tetrafluorotoluene
4-fluoro benzotrifluoride
W-106374
4-Fluorobenzotrifluoride
Benzene, 1-fluoro-4-(trifluoromethyl)-

MDL Number

MFCD00000399

Customs Code

2903999090

FAQ

What is 1-Fluoro-4-(trifluoromethyl)benzene (CAS: 402-44-8)?

1-Fluoro-4-(trifluoromethyl)benzene is an organic compound with the chemical formula C7H3F4. It is a colorless liquid with a distinctive odor. This compound has various applications in the pharmaceutical and chemical industries due to its chemical stability and reactivity.

What are the main uses of 1-Fluoro-4-(trifluoromethyl)benzene (CAS: 402-44-8)?

1-Fluoro-4-(trifluoromethyl)benzene is primarily used as an intermediate in the synthesis of pharmaceuticals, such as certain antipsychotic and antidepressant drugs. It also finds use in the production of pesticides and flame retardants. Its unique properties make it valuable in organic chemistry and material science.

Is 1-Fluoro-4-(trifluoromethyl)benzene (CAS: 402-44-8) safe?

1-Fluoro-4-(trifluoromethyl)benzene is classified as a moderately hazardous chemical. It is not highly toxic but can cause skin irritation and respiratory issues if inhaled or ingested. Proper handling and use of personal protective equipment are recommended. Adequate ventilation and spill containment measures should be in place to ensure safety.

How should 1-Fluoro-4-(trifluoromethyl)benzene (CAS: 402-44-8) be stored?

1-Fluoro-4-(trifluoromethyl)benzene should be stored in a cool, dry place away from direct sunlight and heat sources. Maintain the storage area at a temperature below 25°C. Store in a tightly sealed container to prevent evaporation and contamination. Avoid contact with incompatible materials such as strong oxidizers or strong bases. Ensure proper labeling and segregation from other chemicals to prevent accidents.