2,3,4,5-Tetrafluorobenzonitrile

Basic Information

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CAS Number

16582-93-7

Molecular Formula

C7HF4N

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Boiling Point

165°C

Flash Point

70 ºC

Refractive Index

1.4545-1.4565

SMILES

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C1=C(C(=C(C(=C1F)F)F)F)C#N

InChI

InChI=1S/C7HF4N/c8-4-1-3(2-12)5(9)7(11)6(4)10/h1H

InChIKey

GLTGXIGJLCSEAM-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

211

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

DTXSID00344895
FT-0609344
AMY14253
SCHEMBL809090
tetrafluorobenzonitrile
AKOS005257983
GLTGXIGJLCSEAM-UHFFFAOYSA-
AS-33163
A810670
MFCD00040187
T1882
2,3,4,5-Tetrafluorobenzonitrile
InChI=1/C7HF4N/c8-4-1-3(2-12)5(9)7(11)6(4)10/h1H
CS-0121657
16582-93-7
2,3,3',4',5,5'-HEXACB UNLABELED
2,3,4,5-Tetrafluorbenzonitril
2,3,4,5-tetrafluorobenzenecarbonitrile
tetrafluorocyanobenzene
2,3,4,5-TETRAFLUOROB
4-fluro-3-methylanisole
2H-Tetrafluorobenzonitrile
2,3,4,5-Tetrafluorobenzonitrile,98%
GLTGXIGJLCSEAM-UHFFFAOYSA-N
PubChem9013
Jsp003331
SBB063897
PC0743
VZ22087
LS10189
FCH1115491

MDL Number

MFCD00040187

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 2,3,4,5-Tetrafluorobenzonitrile (CAS: 16582-93-7)?

2,3,4,5-Tetrafluorobenzonitrile (CAS: 16582-93-7) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and must comply with REACH regulations for substances placed on the European market. In the U.S., it is subject to FDA and EPA requirements for hazardous substances. Proper labeling, storage, and disposal are essential to ensure safety and compliance.

Are there alternatives to 2,3,4,5-Tetrafluorobenzonitrile (CAS: 16582-93-7) in synthesis?

While 2,3,4,5-Tetrafluorobenzonitrile (CAS: 16582-93-7) is a key intermediate in several organic synthesis reactions, alternatives such as trifluoromethylbenzonitrile or difluorobenzonitrile may be used. Researchers often explore these alternatives based on the specific application and availability of starting materials.

What is the market or research trend for 2,3,4,5-Tetrafluorobenzonitrile (CAS: 16582-93-7)?

Market trends for 2,3,4,5-Tetrafluorobenzonitrile (CAS: 16582-93-7) are driven by its use in the synthesis of pharmaceuticals and polymer precursors. Research is focusing on developing more efficient synthesis methods and exploring its environmental impact. The growing demand for fluorinated compounds highlights its importance in various industries.

How should waste containing 2,3,4,5-Tetrafluorobenzonitrile (CAS: 16582-93-7) be handled?

Waste containing 2,3,4,5-Tetrafluorobenzonitrile (CAS: 16582-93-7) should be collected in appropriate containers and neutralized if necessary to reduce its environmental impact. It is recommended to incinerate the waste at a licensed facility or use professional waste disposal services to ensure compliance with environmental regulations.