2,3,4,5-Tetrafluorobenzoic acid

Basic Information

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CAS Number

1201-31-6

Molecular Formula

C7H2F4O2

Molecular Weight

194.08 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

86.0 to 89.0 deg-C

Boiling Point

239.2°Cat760mmHg

Flash Point

98.5℃

SMILES

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

InChI

InChI=1S/C7H2F4O2/c8-3-1-2(7(12)13)4(9)6(11)5(3)10/h1H,(H,12,13)

InChIKey

SFKRXQKJTIYUAG-UHFFFAOYSA-N

LogP

1.9412

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

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

MFCD00009613
Benzoic acid, tetrafluoro-
2,3,4,5-Tetrafluorobenzoicacid
2,3,4,5-Tetrafluorobenzoic;2,3,4,5-Tetrafluorobenzoicacid
InChI=1/C7H2F4O2/c8-3-1-2(7(12)13)4(9)6(11)5(3)10/h1H,(H,12,13)
AC-10648
NS00020375
2,3,4,5-Tetrafluorobenzoic acid
EN300-00084
J-506850
SFKRXQKJTIYUAG-UHFFFAOYSA-
2,3,4,5-tetrafluoro benzoic acid
Tetrafluorobenzoic acid
FT-0609343
1201-31-6
CS-0092457
D70864
T1395
AS-10827
2,3,4,5-tetrafluorbenzoic acid
2,3,4,5-Tetrafluorobenzoic acid, 99%
A20446
NSC-168728
Z56896348
Benzoic acid, 2,3,4,5-tetrafluoro-
NSC168728
F0293-0125
AKOS001042135
SY004714
AM20060904
NSC 168728

MDL Number

MFCD00009613

Customs Code

2916399090

FAQ

What is 2,3,4,5-Tetrafluorobenzoic acid (CAS: 1201-31-6)?

2,3,4,5-Tetrafluorobenzoic acid (CAS: 1201-31-6) is an organic compound with the chemical formula C6H2F4COOH. It is a fluorinated derivative of benzoic acid, featuring four fluorine atoms substituted on the benzene ring. This compound is known for its strong acidity and is commonly used in chemical research due to its reactivity and unique properties.

What are the main uses of 2,3,4,5-Tetrafluorobenzoic acid (CAS: 1201-31-6)?

2,3,4,5-Tetrafluorobenzoic acid (CAS: 1201-31-6) is primarily used in pharmaceutical research for the development of drugs with enhanced metabolic stability. It also finds applications in organic synthesis as a versatile intermediate and in the production of specialty chemicals due to its fluorinated structure and reactivity. Its use in food and industrial sectors is limited due to potential toxicity concerns.

Is 2,3,4,5-Tetrafluorobenzoic acid (CAS: 1201-31-6) safe?

2,3,4,5-Tetrafluorobenzoic acid (CAS: 1201-31-6) is considered hazardous due to its potential toxicity. It should be handled with appropriate personal protective equipment (PPE) and in well-ventilated areas. Safety standards recommend avoiding skin contact and inhalation, and it is classified as a substance requiring careful handling in chemical laboratories and industrial settings.

How should 2,3,4,5-Tetrafluorobenzoic acid (CAS: 1201-31-6) be stored?

2,3,4,5-Tetrafluorobenzoic acid (CAS: 1201-31-6) should be stored in a cool, dry, and dark place to maintain stability. It is best kept in a sealed container away from moisture and incompatible materials. Storage conditions should be below 25°C and in a well-ventilated area to prevent degradation and ensure safety.