2,4,6-Trifluorophenol

Basic Information

View in Editor

CAS Number

2268-17-9

Molecular Formula

C6H3F3O

Molecular Weight

148.08 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

49-51 °C

Boiling Point

128.1 °C at 760 mmHg

Flash Point

55.1 °C

Refractive Index

1.471

SMILES

View in Editor

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

InChI

InChI=1S/C6H3F3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H

InChIKey

QQFWMPUXPLBWTG-UHFFFAOYSA-N

LogP

1.8094999999999999

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

108

Safety Information

View Safety Information

GHS Hazard Pictograms

H302

H312

H315

H319

H332

H335

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Hazard Class

Class 4.1 Class 4.1

Synonyms & References

English

DTXSID00334211
SR-1C12
A4846
JS-4098
AC-3819
J-014807
2,4,6-Trifluoro-phenol
AKOS006221430
EN300-1826322
2268-17-9
FT-0609870
AM61850
InChI=1/C6H3F3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10
MFCD00061216
2,4,6-Trifluorophenol
Phenol, 2,4,6-trifluoro-
BP-11128
SY059488
SCHEMBL78286
CHEMBL236138
2,4,6-Trifluorophenol, 99%
2,3-DIHYDROXY-5-METHYLBENZOIC ACID METHYL ESTER
2,4,6-F3C6H2OH
2,4,6-trifluoro-phenol
2,4,6-Trifluor-phenol
Phenol,2,4,6-trifluoro
2,4,6-trifluorophenol

MDL Number

MFCD00061216

Customs Code

29081000

FAQ

What regulatory guidelines apply to 2,4,6-Trifluorophenol (CAS: 2268-17-9)?

2,4,6-Trifluorophenol (CAS: 2268-17-9) falls under the classification of a hazardous chemical according to the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), with specific health and environmental hazards. It is also regulated under the REACH regulations in the European Union, requiring suppliers to provide Safety Data Sheets (SDS) and register with ECHA. FDA and EPA have specific guidelines for handling and disposing of this compound, especially in relation to its use in pharmaceuticals and industrial applications.

Are there alternatives to 2,4,6-Trifluorophenol (CAS: 2268-17-9) in synthesis?

There are several alternatives to 2,4,6-Trifluorophenol (CAS: 2268-17-9) in synthesis, such as 2,4-Difluorophenol, 2,6-Difluorophenol, and other fluoro-substituted phenols. These alternatives can be used to achieve similar functional groups and properties. Common reagents like 2,4,6-trifluorophenyl boronic acid, 2,4,6-trifluorophenyl triflate, and 2,4,6-trifluorophenyl methanol are also available as substitutes depending on the specific requirements of the synthesis process.

What is the market or research trend for 2,4,6-Trifluorophenol (CAS: 2268-17-9)?

The market for 2,4,6-Trifluorophenol (CAS: 2268-17-9) is growing due to its applications in pharmaceuticals, agrochemicals, and electronic materials. Research trends indicate a focus on its synthesis and application in more sustainable and environmentally friendly processes. There is ongoing exploration into its use as a precursor in the production of advanced materials and as a building block in complex molecule synthesis. Additionally, there is increasing interest in its use in green chemistry processes, which aim to reduce the environmental impact of chemical synthesis.

How should waste containing 2,4,6-Trifluorophenol (CAS: 2268-17-9) be handled?

Waste containing 2,4,6-Trifluorophenol (CAS: 2268-17-9) should be collected in appropriate containers and stored in a safe, secure location until disposal. The waste should be neutralized if necessary to reduce its hazardous properties. Professional waste disposal services should be used for final disposal, as this compound is highly reactive and poses both health and environmental hazards. Proper incineration or chemical-neutralization methods should be employed, following local regulations and guidelines to ensure safe disposal. Environmental protection measures should be taken to prevent any accidental release into the environment during handling and disposal.