4-Iodo-2-nitroaniline

Basic Information

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CAS Number

20691-72-9

Molecular Formula

C6H5IN2O2

Molecular Weight

264.02 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

124.0 to 128.0 deg-C

Boiling Point

352.9°C at 760 mmHg

Density

2.101

Flash Point

167.2℃

Refractive Index

1.726

SMILES

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C1=CC(=C(C=C1I)[N+](=O)[O-])N

InChI

InChI=1S/C6H5IN2O2/c7-4-1-2-5(8)6(3-4)9(10)11/h1-3H,8H2

InChIKey

QVCRSYXVWPPBFJ-UHFFFAOYSA-N

LogP

2.88600

Complexity

159

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

Synonyms & References

English

CS-W007996
Benzenamine, 4-iodo-2-nitro-
4-Iodo-2-nitro-phenylamine
EN300-299294
4-Iodo-2-nitroaniline, 97%
20691-72-9
4-Iodo-2-nitrophenylamine
AS-5613
SY008185
J-013528
J-515555
AC-22949
QVCRSYXVWPPBFJ-UHFFFAOYSA-N
QVCRSYXVWPPBFJ-UHFFFAOYSA-
SCHEMBL571279
MFCD06808526
DTXSID70463820
doi:10.14272/QVCRSYXVWPPBFJ-UHFFFAOYSA-N.1
4-iodo-2-nitrobenzenamine
FT-0645992
InChI=1/C6H5IN2O2/c7-4-1-2-5(8)6(3-4)9(10)11/h1-3H,8H2
4-iodo-2-nitro-phenyl amine
AB9490
AKOS005291510
4-iodo-2-nitro-aniline
AM20030317
4-Iodo-2-nitroaniline
I1029
2-nitro-4-iodoaniline
A814819
4-iodanyl-2-nitro-aniline

MDL Number

MFCD06808526

Customs Code

2921420090

FAQ

What regulatory guidelines apply to 4-Iodo-2-nitroaniline (CAS: 20691-72-9)?

4-Iodo-2-nitroaniline (CAS: 20691-72-9) falls under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) as a hazardous chemical. It is also subject to regulatory requirements under REACH in the European Union, which includes registration, evaluation, authorization, and restriction of chemicals. In the United States, it is regulated by the EPA and FDA for environmental and health safety. Proper handling and disposal should comply with local and national regulations to ensure safety and environmental protection.

Are there alternatives to 4-Iodo-2-nitroaniline in synthesis?

Alternatives to 4-Iodo-2-nitroaniline in synthesis include other nitro compounds with different substituents, such as 2-nitro-4-trifluoromethylaniline, or iodine-free analogs like 2-nitroaniline. These alternatives can be used depending on the desired properties and reactivity in the chemical process. Common substitute reagents include other halides or amino acids that can be introduced through different synthetic routes.

What is the market or research trend for 4-Iodo-2-nitroaniline (CAS: 20691-72-9)?

The market for 4-Iodo-2-nitroaniline (CAS: 20691-72-9) is primarily driven by its use in the synthesis of dyes and pigments, pharmaceuticals, and other organic compounds. Research trends are focusing on its applications in medicinal chemistry, particularly in developing new drugs and materials with iodine-based functionalities. Demand is expected to grow as more applications are discovered, especially in areas requiring specific chemical properties.

How should waste containing 4-Iodo-2-nitroaniline (CAS: 20691-72-9) be handled?

Waste containing 4-Iodo-2-nitroaniline (CAS: 20691-72-9) should be collected in compatible containers and stored in a well-ventilated area away from ignition sources. Incineration is a common method for disposal, but it must be conducted under controlled conditions to minimize environmental impact. Professional waste disposal services are recommended for handling such hazardous waste. Environmental protection measures include ensuring containment and preventing accidental spills or leaks during handling and disposal.