2,4,5-Trifluoro-3-hydroxybenzoic acid

Basic Information

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CAS Number

116751-24-7

Molecular Formula

C7H3F3O3

Molecular Weight

192.09 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

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

144.0 to 148.0 deg-C

Boiling Point

292.6 °C at 760 mmHg

Density

1.699

Flash Point

130.8 °C

SMILES

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

InChI

InChI=1S/C7H3F3O3/c8-3-1-2(7(12)13)4(9)6(11)5(3)10/h1,11H,(H,12,13)

InChIKey

YYAFUGSJSHXYNK-UHFFFAOYSA-N

LogP

1.5077

Topological Polar Surface Area

57.53 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

211

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

AKOS000121946
T2380
Benzoic acid, 2,4,5-trifluoro-3-hydroxy-
3-Hydroxy-2 pound not4 pound not5-trifluorobenzoic acid
CS-0204558
EN300-31321
AS-12045
YYAFUGSJSHXYNK-UHFFFAOYSA-N
Z321036538
3-Hydroxy-2,4,5-trifluorobenzoic acid
FT-0609797
MFCD00800378
J-512618
A2406
SCHEMBL1056666
DTXSID90370188
3-Hydroxy-2,4,5-trifluorobenzoic acid, 97%
AC-3995
3-Hydroxy-2,4,5-trifluorobenzoicacid
116751-24-7
2,4,5-Trifluoro-3-hydroxybenzoic acid
2.4,5-trifluoro-3-hydroxybenzoic acid
2,4,5-Trifluoro-3-hydroxy-benzoic acid
C7H3F3O3
2,3-DIHYDRO-1H-INDOLE-4-CARBONITRILE
2,4,5-tifluoro-3-hydronybenzoic
2,4,5-Trifluoro-3-Hydroxybenzo
3-Hydroxy-2
3-Hydroxy-2,4,5-trif
3-Carboxy-2,5,6-trifluorophenol
2,4,5-TRIFLUORO-3-HYDROXYBENZOIC ACID

MDL Number

MFCD00800378

Customs Code

2918290000

FAQ

What regulatory guidelines apply to 2,4,5-Trifluoro-3-hydroxybenzoic acid (CAS: 116751-24-7)?

2,4,5-Trifluoro-3-hydroxybenzoic acid (CAS: 116751-24-7) falls under the scope of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) due to its hazardous properties. For regulatory compliance, it must adhere to REACH regulations in the European Union, ensuring that all suppliers and manufacturers are aware of its handling and disposal requirements. Additionally, the US FDA and EPA have specific guidelines for the use and disposal of this compound, particularly in pharmaceutical and industrial applications.

Are there alternatives to 2,4,5-Trifluoro-3-hydroxybenzoic acid (CAS: 116751-24-7) in synthesis?

In the synthesis of 2,4,5-Trifluoro-3-hydroxybenzoic acid (CAS: 116751-24-7), alternatives such as 2,4-difluoro-3-hydroxybenzoic acid or 4-fluoro-3-hydroxybenzoic acid can be used. These alternatives can serve as viable substitutes depending on the specific reaction conditions and desired product purity. Other common reagents that may be considered include benzoic acid derivatives with varying fluorine positions or substituents.

What is the market or research trend for 2,4,5-Trifluoro-3-hydroxybenzoic acid (CAS: 116751-24-7)?

The market for 2,4,5-Trifluoro-3-hydroxybenzoic acid (CAS: 116751-24-7) is primarily driven by its applications in pharmaceuticals and agrochemicals. Research trends indicate a growing interest in utilizing this compound for its unique properties, such as its stability and reactivity. With ongoing developments in drug discovery and synthesis optimization, the demand for this compound is expected to increase, particularly in the exploration of novel therapeutic agents and pesticides.

How should waste containing 2,4,5-Trifluoro-3-hydroxybenzoic acid (CAS: 116751-24-7) be handled?

Waste containing 2,4,5-Trifluoro-3-hydroxybenzoic acid (CAS: 116751-24-7) should be collected and disposed of in accordance with local and international regulations. It is important to neutralize the waste with an appropriate base or acid to prevent environmental contamination. Professional waste disposal services are recommended for safe incineration or other environmentally sound disposal methods. Proper labeling and documentation of the waste are essential to ensure compliance with regulatory requirements and to protect the environment.