2-Fluoro-4-iodo-1-methylbenzene

Basic Information

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CAS Number

39998-81-7

Molecular Formula

C7H6FI

Molecular Weight

236.03 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

22 °C

Boiling Point

206-208℃ at 760 mmHg

Flash Point

79 ºC

Refractive Index

1.577-1.579

SMILES

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CC1=C(C=C(C=C1)I)F

InChI

InChI=1S/C7H6FI/c1-5-2-3-6(9)4-7(5)8/h2-4H,1H3

InChIKey

QZLWTFTXGKKCHZ-UHFFFAOYSA-N

LogP

2.7387200000000007

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

94.9

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

H227

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

H227 Combustible liquid
Flammable liquids

Hazard Class

Class IRRITANT Class IRRITANT

Sensitiveness

Light Sensitive

Synonyms & References

English

OXZ7JMG1YB
A6680
2-Fluoro-4-iodo-1-methylbenzene #
UNII-OXZ7JMG1YB
FT-0602089
SCHEMBL419343
EINECS 254-740-6
NS00057830
EN300-213875
2-Fluoro-4-iodo-1-methylbenzene
DTXSID70193054
F0720
InChI=1/C7H6FI/c1-5-2-3-6(9)4-7(5)8/h2-4H,1H
3-fluoro-4-methyl-iodobenzene
2-Fluoro-4-iodotoluene
AKOS009157606
SY013795
DS-14280
AM61951
2-fluoro-4-iodo-toluene
Benzene, 2-fluoro-4-iodo-1-methyl-
2-fluoro-4-iodo-1-methyl-benzene
MFCD00001045
39998-81-7
CS-W001920

MDL Number

MFCD00001045

Customs Code

2903999090

FAQ

What regulatory guidelines apply to 2-Fluoro-4-iodo-1-methylbenzene (CAS: 39998-81-7)?

2-Fluoro-4-iodo-1-methylbenzene (CAS: 39998-81-7) falls under various regulatory guidelines. For safety and environmental protection, it should comply with the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations, and FDA/EPA requirements. Specific handling, storage, and disposal procedures must be adhered to, including proper labeling and documentation of material safety data sheets (MSDS).

Are there alternatives to 2-Fluoro-4-iodo-1-methylbenzene (CAS: 39998-81-7) in synthesis?

In synthesis, 2-Fluoro-4-iodo-1-methylbenzene (CAS: 39998-81-7) can be replaced by analogs such as 2-chloro-4-iodo-1-methylbenzene or 2-bromo-4-iodo-1-methylbenzene. Common alternative reagents include iodine and fluoro compounds. These alternatives offer similar functional groups but may have different reactivity and synthesis pathways.

What is the market or research trend for 2-Fluoro-4-iodo-1-methylbenzene (CAS: 39998-81-7)?

The market for 2-Fluoro-4-iodo-1-methylbenzene (CAS: 39998-81-7) reflects growing interest in specialized organic intermediates for pharmaceuticals and materials science. Research trends indicate increasing demand for novel compounds with unique chemical functionalities. Price trends show volatility due to supply and demand dynamics, with emerging applications in drug synthesis driving market growth.

How should waste containing 2-Fluoro-4-iodo-1-methylbenzene (CAS: 39998-81-7) be handled?

Waste containing 2-Fluoro-4-iodo-1-methylbenzene (CAS: 39998-81-7) should be collected in appropriate containers and stored in a secure, well-ventilated area. It is advisable to incinerate the waste or have it professionally disposed of by a licensed hazardous waste facility. Environmental precautions include strict adherence to local regulations and the use of personal protective equipment (PPE) during handling to minimize exposure and environmental impact.