2,3,5,6-Tetrafluoro Benzoic Acid

Basic Information

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CAS Number

652-18-6

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

150.0 to 154.0 deg-C

Boiling Point

227.9℃ at 760 mmHg

Density

1.5165 (estimate)

Flash Point

91.6 °C

SMILES

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

InChI

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

InChIKey

KVLBXIOFJUWSJQ-UHFFFAOYSA-N

LogP

1.9412

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

197

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H318 Causes serious eye damage
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Class CORROSIVE Class CORROSIVE

Synonyms & References

English

2,3,5,6-Tetrafluorobenzoic acid
DTXSID20340798
SY018202
CHEMBL1207225
FT-0609424
SR-01000512651-1
Z1255445912
MFCD00002408
652-18-6
EN300-97434
ALLYL2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE
T1881
EC 416-800-1
NS00003592
AKOS015889830
PS-10112
Benzoic acid, 2,3,5,6-tetrafluoro-
CS-0121656
AM20040959
A835024
SCHEMBL503507
SR-01000512651
2,3,4,5-TETRAHYDRO-1-BENZOXEPIN-7-OL
2,3,5,6-Tetrafluorbenzoesaeure
2,3,5,6-Tetrafluorobenzoicacid
KVLBXIOFJUWSJQ-UHFFFAOYSA-N
PubChem1341
SBB064023
KM0911
Benzoic acid,2,3,5,6-tetrafluoro-
CM12869

MDL Number

MFCD00002408

FAQ

What regulatory guidelines apply to 2,3,5,6-Tetrafluoro Benzoic Acid (CAS: 652-18-6)?

2,3,5,6-Tetrafluoro Benzoic Acid (CAS: 652-18-6) falls under the GHS classification as an organic peroxide. It must comply with REACH regulations in the EU, which require suppliers to register substances above one tonne annually. The FDA regulates its use in food contact applications, while the EPA oversees its handling and disposal to ensure environmental safety.

Are there alternatives to 2,3,5,6-Tetrafluoro Benzoic Acid (CAS: 652-18-6) in synthesis?

Synthetic alternatives to 2,3,5,6-Tetrafluoro Benzoic Acid (CAS: 652-18-6) include 2,4,5,6-Tetrafluoro Benzoic Acid and Pentafluorobenzoic Acid. These can be used as substitutes in various reactions. Additionally, researchers often explore fluorinated carboxylic acids as alternatives depending on the specific application.

What is the market or research trend for 2,3,5,6-Tetrafluoro Benzoic Acid (CAS: 652-18-6)?

The market for 2,3,5,6-Tetrafluoro Benzoic Acid (CAS: 652-18-6) is growing due to its use in pharmaceuticals and organic synthesis. Recent research trends focus on its application in medicine and as a precursor for fluorochemicals. Price trends indicate steady demand, though prices can fluctuate based on supply chain disruptions and raw material costs.

How should waste containing 2,3,5,6-Tetrafluoro Benzoic Acid (CAS: 652-18-6) be handled?

Waste containing 2,3,5,6-Tetrafluoro Benzoic Acid (CAS: 652-18-6) should be collected in sealed, labeled containers and disposed of through a professional hazardous waste management service. Incineration is a common method, but proper environmental precautions must be taken to prevent release of toxic fluorine compounds. Always ensure compliance with local, state, and federal regulations regarding hazardous waste disposal.