4-Fluoro-2-(trifluoromethyl)benzoic acid

Basic Information

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CAS Number

141179-72-8

Molecular Formula

C8H4F4O2

Molecular Weight

208.11 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

121.0 to 125.0 deg-C

Boiling Point

239 °C at 760 mmHg

Density

1.4412 (estimate)

Flash Point

98.3℃

SMILES

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C1=CC(=C(C=C1F)C(F)(F)F)C(=O)O

InChI

InChI=1S/C8H4F4O2/c9-4-1-2-5(7(13)14)6(3-4)8(10,11)12/h1-3H,(H,13,14)

InChIKey

JUHPDXOIGLHXTC-UHFFFAOYSA-N

LogP

2.5427

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

226

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

Synonyms & References

English

FT-0618446
Benzoic acid, 4-fluoro-2-(trifluoromethyl)-
SCHEMBL334641
4-fluoro-2-(trifluoromethyl) benzoic acid
alpha,alpha,alpha,4-Tetrafluoro-o-toluic Acid
CS-W015235
JUHPDXOIGLHXTC-UHFFFAOYSA-
AM20060118
AC-3992
SY013105
EN300-69980
141179-72-8
BCP26763
DTXSID90350849
InChI=1/C8H4F4O2/c9-4-1-2-5(7(13)14)6(3-4)8(10,11)12/h1-3H,(H,13,14)
4-Fluoro-2-(trifluoromethyl)benzoic acid, 98%
4-Fluoro-2-(trifluoromethyl)benzoic acid
J-007468
4-fluoro-2-trifluoromethylbenzoic acid
2-trifluoromethyl-4-fluorobenzoic acid
PS-8049
4-fluoro-2(trifluoromethyl)benzoic acid
AKOS005255850
MFCD00040982
F0577
4-Fluoro-2-(trifluoromethyl)benzoic acid, 97+%
Z1123696306
CK2236
4-fluoro-2-(trifluoromethyl)benzoicacid
RARECHEM AL BO 0635
TIMTEC-BB SBB006651

MDL Number

MFCD00040982

Customs Code

2916399090

FAQ

What is 4-Fluoro-2-(trifluoromethyl)benzoic acid (CAS: 141179-72-8)?

4-Fluoro-2-(trifluoromethyl)benzoic acid (CAS: 141179-72-8) is an organic compound characterized by its aromatic structure with a fluorine atom and three fluorine atoms attached to the methyl group. It is used in pharmaceuticals for its potential as a drug intermediate and in research for its biochemical activity.

What are the main uses of 4-Fluoro-2-(trifluoromethyl)benzoic acid (CAS: 141179-72-8)?

4-Fluoro-2-(trifluoromethyl)benzoic acid is primarily used as a pharmaceutical intermediate in the development of drugs. It is also utilized in research for its biological activity and in the synthesis of other organic compounds.

Is 4-Fluoro-2-(trifluoromethyl)benzoic acid (CAS: 141179-72-8) safe?

4-Fluoro-2-(trifluoromethyl)benzoic acid is generally safe when handled with appropriate precautions. It is important to wear protective gloves and goggles when working with the compound to avoid skin and eye contact. It should be stored away from sources of heat and light to minimize the risk of degradation.

How should 4-Fluoro-2-(trifluoromethyl)benzoic acid (CAS: 141179-72-8) be stored?

4-Fluoro-2-(trifluoromethyl)benzoic acid should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent degradation and contamination. Proper ventilation should be ensured during storage to avoid the accumulation of flammable vapors.