2-Fluoro-4-nitroanisole

Basic Information

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CAS Number

455-93-6

Molecular Formula

C7H6FNO3

Molecular Weight

171.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

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

103.0 to 107.0 deg-C

Boiling Point

227.5°C at 760 mmHg

Density

1.321

Flash Point

121.4 °C

Refractive Index

1.552

SMILES

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COC1=C(C=C(C=C1)[N+](=O)[O-])F

InChI

InChI=1S/C7H6FNO3/c1-12-7-3-2-5(9(10)11)4-6(7)8/h2-4H,1H3

InChIKey

XGMVTXUXZUPGGY-UHFFFAOYSA-N

LogP

2.26570

Complexity

171

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

DS-0877
2-Fluoro-1-methoxy-4-nitrobenzene
4-nitro-2-fluoroanisol
455-93-6
J-509425
NSC10335
F0617
SCHEMBL296681
2-Fluoro-1-methoxy-4-nitrobenzene #
DTXSID90278852
Nitrobenzene, 3-fluoro-4-methoxy-
A7180
MFCD00061095
AC-3804
CS-0007667
2-fluoro-1-methoxy-4-nitro-benzene
NS00126604
AKOS005254960
BENZENE, 2-FLUORO-1-METHOXY-4-NITRO-
SY021115
FT-0612339
2-fluoro-4-nitroanisol
NSC-10335
2-Fluoro-4-nitroanisole, 98%
AM20060897
2-Fluoro-4-nitroanisole
2-fluoro-1-methoxy-4-nitrobenzene
Anisole,2-fluoro-4-nitro- (6CI,8CI)
3-Fluoro-4-methoxynitrobenzene
NSC 10335

MDL Number

MFCD00061095

Customs Code

2909309090

FAQ

What are the physical and chemical properties of 2-Fluoro-4-nitroanisole (CAS: 455-93-6)?

2-Fluoro-4-nitroanisole (CAS: 455-93-6) is a crystalline solid with a molecular weight of approximately 213.05 g/mol. It has a low solubility in water (0.4 g/100 mL at 25°C) but is more soluble in organic solvents like ethanol and dichloromethane. This compound is moderately reactive, particularly towards reduction and substitution reactions. It typically exists as a solid at room temperature and is stable under normal conditions but should be stored away from moisture and oxidizing agents.

How is 2-Fluoro-4-nitroanisole (CAS: 455-93-6) typically synthesized?

2-Fluoro-4-nitroanisole (CAS: 455-93-6) is synthesized via the nitration of 2-fluoroanisole. This is commonly achieved using nitric acid in the presence of sulfuric acid as a catalyst. The reaction is typically carried out at low temperatures to control the selectivity and yield. The product is then purified by recrystallization or other common purification techniques.

What industries use 2-Fluoro-4-nitroanisole (CAS: 455-93-6)?

2-Fluoro-4-nitroanisole (CAS: 455-93-6) is used in various industries, particularly in pharmaceuticals and organic synthesis. It serves as a precursor in the development of drugs and as a reagent in the synthesis of other organic compounds. Additionally, it has applications in the production of dyes and in the development of certain materials for sensors and semiconductors.

What precautions should be taken when handling 2-Fluoro-4-nitroanisole (CAS: 455-93-6)?

When handling 2-Fluoro-4-nitroanisole (CAS: 455-93-6), it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be conducted in a well-ventilated area or a fume hood to minimize exposure to fumes. Spills should be cleaned up using absorbent materials and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.