1-Fluoro-3-nitrobenzene

Basic Information

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CAS Number

402-67-5

Molecular Formula

C6H4FNO2

Molecular Weight

141.1 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

1.7 °C

Boiling Point

205 °C

Refractive Index

n20/D 1.525(lit.)

SMILES

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C1=CC(=CC(=C1)F)[N+](=O)[O-]

InChI

InChI=1S/C6H4FNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H

InChIKey

WMASLRCNNKMRFP-UHFFFAOYSA-N

LogP

2.25710

Complexity

134

Safety Information

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Hazard Statement

H373 Causes damage to organs through prolonged or repeated exposure
Specific target organ toxicity, repeated exposure

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

BCP16131
FT-0615737
3-nitrofluorobenzene
META FLUORO NITROBENZENE
3-Fluoronitrobenzene
1-fluoro-3-nitro benzene
AS-33375
UNII-CCK4NSJ7M3
Q63395619
3-FluoronitrobenzenE;3-Fluoro-1-nitrobenzene;M-Nitrofluorobenzene
F0110
m-Fluoronitrobenzene
2-fluoro-4-nitrobenzene
3-fluoro-nitrobenzene
NSC60651
NS00042783
MFCD00007196
AM20040406
NSC-60651
CHEMBL164634
1-Fluoro-3-nitrobenzene, 97%
1-Fluoro-3-nitrobenzene, purum, >=97.0% (GC)
1-NITRO-3-FLUOROBENZENE
EINECS 206-953-0
CCK4NSJ7M3
AKOS000120876
EN300-20820
NSC 60651
InChI=1/C6H4FNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4
Benzene, 1-fluoro-3-nitro-
402-67-5

MDL Number

MFCD00007196

Customs Code

29049085

FAQ

What are the physical and chemical properties of 1-Fluoro-3-nitrobenzene (CAS: 402-67-5)?

1-Fluoro-3-nitrobenzene (CAS: 402-67-5) is a yellow crystalline solid with a molecular weight of approximately 173.04 g/mol. It has a density of about 1.39 g/cm³ and a melting point of 56-57°C. This compound is slightly soluble in water but highly soluble in organic solvents like benzene and toluene. It is known for its reactivity, particularly towards nucleophilic substitution and reduction reactions.

How is 1-Fluoro-3-nitrobenzene (CAS: 402-67-5) typically synthesized?

1-Fluoro-3-nitrobenzene is typically synthesized through the nitration of 1-fluorobenzene. This process involves treating 1-fluorobenzene with a mixture of concentrated sulfuric acid and concentrated nitric acid under controlled conditions. The reaction is exothermic, and proper cooling is necessary to prevent over-nitration. The product can be isolated by extraction and recrystallization.

What industries use 1-Fluoro-3-nitrobenzene (CAS: 402-67-5)?

1-Fluoro-3-nitrobenzene (CAS: 402-67-5) is used in the pharmaceutical industry for the synthesis of various organic compounds. It is also found in the chemical industry for the production of dyes, pigments, and other organic intermediates. Additionally, this compound finds applications in the polymer industry as a monomer for certain types of plastics and in the electronics industry for the fabrication of semiconductors.

What precautions should be taken when handling 1-Fluoro-3-nitrobenzene (CAS: 402-67-5)?

Proper handling of 1-Fluoro-3-nitrobenzene (CAS: 402-67-5) requires the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. This compound should be handled in a fume hood due to its volatility and potential for inhalation. In case of spillage, immediate cleanup is necessary using appropriate absorbents, and the area should be ventilated. Safety data sheets (SDS) should be consulted for detailed emergency procedures and storage guidelines.