3,4,5-Trifluoro Benzoic Acid

Basic Information

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CAS Number

121602-93-5

Molecular Formula

C7H3F3O2

Molecular Weight

176.09 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

97.0 to 99.0 deg-C

Boiling Point

116-118C/100Torr

Flash Point

105.9 °C

Refractive Index

1,471-1,473

SMILES

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

InChI

InChI=1S/C7H3F3O2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H,11,12)

InChIKey

VJMYKESYFHYUEQ-UHFFFAOYSA-N

LogP

1.8021

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

174

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

255875-61-7
FT-0602378
Z1080514246
VJMYKESYFHYUEQ-UHFFFAOYSA-N
3,4,5-Trifluorobenzoicacid
InChI=1/C7H3F3O2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H,11,12
T1640
AKOS005614418
SY022899
EN300-68819
DTXSID50357399
121602-93-5
J-511109
AM61303
3,4,5-Trifluorobenzoic acid
MFCD00074962
AS-14504
AC-4010
SCHEMBL221480
3,4,5-trifluoro benzoic acid
3,4,5-trifluoro-benzoic acid
3,4,5-Trifluorobenzoic acid, 98%
CS-W001340
Benzoic acid, 3,4,5-trifluoro-
BUTTPARK 30\01-46
RARECHEM AL BO 0682
3-flurobenzenenitrile
3,4,5-Trifluorobenzoic
3,4,5-Trifluorobenzoicacid98%
3,4,5-Trifluorobenzoic acid 98%
3,4,5-TRIFLUOROBENZOIC ACID

MDL Number

MFCD00074962

Customs Code

2916399090

FAQ

What is 3,4,5-Trifluoro Benzoic Acid (CAS: 121602-93-5)?

3,4,5-Trifluoro Benzoic Acid (CAS: 121602-93-5) is an organic compound with the molecular formula C7H3F3O2. It is a white or slightly yellow crystalline solid at room temperature. This compound is known for its acidic properties and is widely used in the synthesis of other organic compounds, pharmaceuticals, and as a reagent in various chemical reactions.

What are the main uses of 3,4,5-Trifluoro Benzoic Acid (CAS: 121602-93-5)?

3,4,5-Trifluoro Benzoic Acid (CAS: 121602-93-5) is primarily used in the pharmaceutical industry for the synthesis of drugs and intermediates. It is also used as a reagent in organic synthesis and as an analytical reagent. Additionally, it finds applications in the research and development of new materials and as a component in some industrial cleaning agents.

Is 3,4,5-Trifluoro Benzoic Acid (CAS: 121602-93-5) safe?

3,4,5-Trifluoro Benzoic Acid (CAS: 121602-93-5) is generally considered safe when handled with appropriate precautions. However, it should be stored and used in a well-ventilated area to avoid inhalation of dust or fumes. Protective gloves and safety goggles should be worn. It is also important to avoid contact with skin and eyes. In case of accidental contact, wash thoroughly with water and seek medical advice if necessary.

How should 3,4,5-Trifluoro Benzoic Acid (CAS: 121602-93-5) be stored?

3,4,5-Trifluoro Benzoic Acid (CAS: 121602-93-5) should be stored in a cool, dry place, protected from light. It should be kept in a tightly sealed container to prevent moisture and air exposure. The storage temperature should be between 0°C and 25°C. Avoid storing it near incompatible substances such as bases or reducing agents. It is recommended to store it away from heat sources and direct sunlight.