1-Fluoro-2-iodo-4-nitrobenzene

Basic Information

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CAS Number

177363-10-9

Molecular Formula

C6H3FINO2

Molecular Weight

267 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

Basic Physical Properties

Boiling Point

287.0±20.0 ºC (760 Torr),

Flash Point

127.3±21.8 ºC,

SMILES

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

InChI

InChI=1S/C6H3FINO2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H

InChIKey

XSFIPDPCQOJJFR-UHFFFAOYSA-N

Complexity

161

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Synonyms & References

English

1-Fluoro-2-iodo-4-nitrobenzene
4-Fluoro-3-iodonitrobenzene
Benzene, 1-fluoro-2-iodo-4-nitro-
2-iodo 4-nitro fluorobenzene
3-Iodo-4-fluoro-1-nitrobenzene
XSFIPDPCQOJJFR-UHFFFAOYSA-N
AK136589
SY041733
CS-0041294
EN300-95261
DTXSID20441512
177363-10-9
MFCD08461002
AMY28171
CHA36310
A904947
AKOS009476532
DB-184844
SCHEMBL1024831
DS-5542

MDL Number

MFCD08461002

FAQ

What are the physical and chemical properties of 1-Fluoro-2-iodo-4-nitrobenzene (CAS: 177363-10-9)?

1-Fluoro-2-iodo-4-nitrobenzene (CAS: 177363-10-9) is a crystalline solid with a molecular weight of approximately 293.01 g/mol. It has a low solubility in water but is more soluble in common organic solvents like dichloromethane and ethanol. The compound is known for its high reactivity due to the presence of multiple functional groups, making it susceptible to substitution and reduction reactions.

How is 1-Fluoro-2-iodo-4-nitrobenzene (CAS: 177363-10-9) typically synthesized?

1-Fluoro-2-iodo-4-nitrobenzene (CAS: 177363-10-9) can be synthesized via a multistep process involving the iodination of 1-fluoro-4-nitrobenzene followed by nitration. Common reagents include iodine in the presence of base and nitric acid. The synthesis typically yields about 70-80% of the desired product with good selectivity for the 2-iodo position.

What industries use 1-Fluoro-2-iodo-4-nitrobenzene (CAS: 177363-10-9)?

1-Fluoro-2-iodo-4-nitrobenzene (CAS: 177363-10-9) is primarily used in the pharmaceutical industry for the synthesis of certain drugs. It is also utilized in the production of organic semiconductors and as an intermediate in the development of sensors and polymers. Its unique functional groups make it valuable for a variety of applications in chemical research and development.

What precautions should be taken when handling 1-Fluoro-2-iodo-4-nitrobenzene (CAS: 177363-10-9)?

When handling 1-Fluoro-2-iodo-4-nitrobenzene (CAS: 177363-10-9), it is essential to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. The compound should be stored in a cool, dry place away from direct sunlight. In case of spill, use appropriate absorbent materials and clean up under a fume hood. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information.