2,3,4-Trifluoro Benzoic Acid

Basic Information

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CAS Number

61079-72-9

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

140.0 to 143.0 deg-C

Boiling Point

245.3°C at 760 mmHg

Density

1,404g/cm

Flash Point

102.1℃

Refractive Index

1,482

SMILES

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

InChI

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

InChIKey

WEPXLRANFJEOFZ-UHFFFAOYSA-N

LogP

1.8021000000000003

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

186

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

F0001-1603
2,3,4-Trifluorobenzoic acid, 98%
EN300-98853
2,3,4-Trifluorobenzoic acid
NSC190684
DTXSID70307311
NSC-190684
MFCD00061232
AS-11581
AC-2524
Z1192357319
NS00126269
NCGC00336980-01
SCHEMBL241797
61079-72-9
AKOS005063936
AM20040850
NSC 190684
AB01330199-02
2,3,4-Trifluorobenzoicacid
J-506865
Benzoic acid, 2,3,4-trifluoro-
SY001815
FT-0609380
T1867
CS-0017141
A8484
2,3,4-3-Fluorobenzoic acid
RARECHEM AL BO 0257
TIMTEC-BB SBB006557
BUTTPARK 30\01-45

MDL Number

MFCD00061232

Customs Code

2916399090

FAQ

What is 2,3,4-Trifluoro Benzoic Acid (CAS: 61079-72-9)?

2,3,4-Trifluoro Benzoic Acid (CAS: 61079-72-9) is an organic compound with the molecular formula C7H4F3CO2H. It is a derivative of benzoic acid, featuring three fluorine atoms substituted on the benzene ring. This compound is known for its acidic properties and is commonly used in chemical synthesis due to its reactivity and functional group versatility.

What are the main uses of 2,3,4-Trifluoro Benzoic Acid (CAS: 61079-72-9)?

2,3,4-Trifluoro Benzoic Acid (CAS: 61079-72-9) is primarily used in pharmaceutical research for the development of drugs with enhanced metabolic stability and bioavailability. It also finds applications in industrial chemistry as an intermediate for producing various fluorinated compounds and in organic synthesis for creating complex molecules with tailored properties.

Is 2,3,4-Trifluoro Benzoic Acid (CAS: 61079-72-9) safe?

2,3,4-Trifluoro Benzoic Acid (CAS: 61079-72-9) is considered toxic if ingested or inhaled in large quantities. It should be handled with appropriate protective measures, such as gloves and a fume hood. Safety standards recommend avoiding prolonged exposure and following OSHA guidelines for chemical handling in laboratories and industrial settings.

How should 2,3,4-Trifluoro Benzoic Acid (CAS: 61079-72-9) be stored?

2,3,4-Trifluoro Benzoic Acid (CAS: 61079-72-9) should be stored in a cool, dry, and well-ventilated place, away from direct light. It is best kept in a sealed container to prevent moisture absorption. Proper storage ensures stability and minimizes the risk of degradation or chemical reaction with other substances.