4-Fluoro-3-(trifluoromethyl)benzaldehyde

Basic Information

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CAS Number

67515-60-0

Molecular Formula

C8H4F4O

Molecular Weight

192.11 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

114.0~116.0ºC

Boiling Point

60°C/0.5mmHg

Density

1.408 g/mL at 25 °C

Refractive Index

n20/D 1.457(lit.)

SMILES

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C1=CC(=C(C=C1C=O)C(F)(F)F)F

InChI

InChI=1S/C8H4F4O/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-4H

InChIKey

BIUDHHGROGJSHN-UHFFFAOYSA-N

LogP

2.657000000000001

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

189

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

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 IRRITANT Class IRRITANT

Sensitiveness

Air Sensitive

Synonyms & References

English

67515-60-0
4-fluoro-3-trifluromethylbenzaldehyde
4-Fluoro-3-(trifluoromethyl)benzaldehyde
A1772
PS-8343
4fluoro-3-trifluoromethyl benzaldehyde
4-fluoro-5-(trifluoromethyl)benzaldehyde
4-Fluoro-3-(trifluoromethyl)
4-fluoro-3-trifluoromethylbenzaldehyde
AC-3854
4-fluoro-3-(trifluoromethyl) benzaldehyde
3-trifluoromethyl-4-fluoro-benzaldehyde
SCHEMBL67628
AKOS005259737
Benzaldehyde, 4-fluoro-3-(trifluoromethyl)-
CS-W015826
4-fluoro-3-trifluoromethyl benzaldehyde
3-(trifluoromethyl)-4-fluoro-benzaldehyde
DTXSID10334904
4-fluoro-3-trifluoromethyl-benzaldehyde
AM20040998
4-Fluoro-3-(trifluoromethyl)benzaldehyde, 97%
MFCD00061314
SY016855
FT-0618467
Z1065862606
EN300-67006
F0545
4-Fluoro-3-trifluoromethylbenzaldehyde
alpha,alpha,alpha,4-Tetrafluoro-m-tolualdehyde
3-Trifluoromethyl-4-Fluorobenzaldehyde

MDL Number

MFCD00061314

Customs Code

2913000090

FAQ

What are the physical and chemical properties of 4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS: 67515-60-0)?

4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS: 67515-60-0) is a white crystalline solid with a molecular weight of 252.12 g/mol. It has a melting point of 59-61°C and is slightly soluble in water. This compound is highly reactive due to the presence of the aldehyde group and fluorine substituents, making it an active molecule in organic synthesis.

How is 4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS: 67515-60-0) typically synthesized?

4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS: 67515-60-0) can be synthesized via the reaction of 3-(trifluoromethyl)benzaldehyde with fluoride sources such as tetrabutylammonium fluoride (TBAF). The reaction is carried out under anhydrous conditions to enhance yield and selectivity. The use of catalysts like palladium complexes can improve the reaction efficiency and minimize side products.

What industries use 4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS: 67515-60-0)?

4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS: 67515-60-0) is primarily used in the pharmaceutical industry for the synthesis of various drug intermediates. It also finds applications in the polymer industry for the development of novel materials, in sensor technology for detecting specific gases, and in semiconductor manufacturing for etching processes.

What precautions should be taken when handling 4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS: 67515-60-0)?

When handling 4-Fluoro-3-(trifluoromethyl)benzaldehyde (CAS: 67515-60-0), it is essential to wear personal protective equipment such as gloves, goggles, and a lab coat. Ensure the use of a fume hood to avoid inhalation of vapors. Spills should be cleaned up with caution using appropriate absorbents, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.