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4-Isothiocyanato-N-(4-nitrophenyl)aniline

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Identification
Molecular formula
C13H9N3O2S
CAS number
4203-78-9
IUPAC name
4-isothiocyanato-N-(4-nitrophenyl)aniline
State
State

At room temperature, 4-Isothiocyanato-N-(4-nitrophenyl)aniline is a solid, which is typical of aromatic compounds with moderate to high molecular weight. It is important to handle it with care, especially considering its nitro group, which might affect its stability and reactivity.

Melting point (Celsius)
250.00
Melting point (Kelvin)
523.15
Boiling point (Celsius)
445.00
Boiling point (Kelvin)
718.15
General information
Molecular weight
269.30g/mol
Molar mass
269.2960g/mol
Density
1.4000g/cm3
Appearence

The compound typically appears as a yellow crystalline solid. This colored crystalline form is a characteristic appearance for compounds containing aromatic and nitro functional groups, indicating the presence of conjugated systems.

Comment on solubility

Solubility of 4-isothiocyanato-N-(4-nitrophenyl)aniline

4-isothiocyanato-N-(4-nitrophenyl)aniline, with a complex structure, demonstrates interesting solubility characteristics influenced by its functional groups. Here are some key points regarding its solubility:

  • Polar vs. Nonpolar Solvent: This compound is expected to have greater solubility in polar solvents due to the presence of the isothiocyanate functional group, which can engage in hydrogen bonding.
  • Limited Water Solubility: The compound is likely to have limited solubility in water, which can be attributed to its large aromatic rings that generally hinder interactions with water molecules.
  • Organic Solvents: It is more soluble in organic solvents such as ethanol or acetonitrile, as these solvents can better accommodate the molecule's hydrophobic regions.
  • Temperature Dependence: Solubility can vary with temperature; increasing temperature often enhances the solubility of organic compounds in solvents.
  • Concentration Impact: Precautions should be taken with concentration, as high concentrations may lead to precipitation due to reduced solubility limits.

To summarize, the solubility behavior of 4-isothiocyanato-N-(4-nitrophenyl)aniline suggests that it is more compatible with polar organic solvents rather than being water-soluble. Understanding these solubility properties is essential for applications in chemical synthesis and formulation.

Interesting facts

Interesting Facts about 4-Isothiocyanato-N-(4-nitrophenyl)aniline

4-Isothiocyanato-N-(4-nitrophenyl)aniline, a fascinating chemical compound, has garnered attention in various fields of research due to its unique properties and applications. Below are some key points that make this compound particularly interesting:

  • Versatile Reactivity: The isothiocyanate functional group is known for its versatility in synthesis. It can easily participate in nucleophilic reactions, which is advantageous for creating complex molecular architectures.
  • Biological Significance: Compounds containing isothiocyanate groups have been studied for their potential biological activities, ranging from anti-cancer properties to acting as anti-inflammatory agents. They play crucial roles in plant defense mechanisms, making them of interest in agricultural chemistry.
  • Application in Sensors: This compound can be utilized in the design of chemical sensors. The nitro group can enhance electronic properties, allowing for the development of sensitive analytical devices through hybridization with various materials.
  • Research in Organic Chemistry: The compound serves as a useful intermediate in organic reactions, enabling the synthesis of various other chemical derivatives. Such derivatives may possess unique optical or electronic properties that can be exploited in advanced material science.
  • Educational Value: For chemistry students, studying compounds like 4-isothiocyanato-N-(4-nitrophenyl)aniline is pivotal, as it provides insights into the reactivity of isothiocyanates and nitro compounds, aiding in understanding core concepts of functional groups and reactivity principles.

In summary, 4-Isothiocyanato-N-(4-nitrophenyl)aniline is more than just a chemical compound; it exemplifies the intricate connections between chemical structure, reactivity, and real-world applications. As research continues to evolve, the implications of such compounds promise to span a wide range of scientific domains.

Synonyms
Amoscanate
26328-53-0
Nithiocyamine
Amoscanato
Amoscanatum
4-isothiocyanato-N-(4-nitrophenyl)aniline
Ciba 9333 GO
4-Isothiocyanato-4'-nitrodiphenylamine
p-(p-Nitroanilino)phenyl isothiocyanate
CCRIS 4111
4-(4-Nitroanilino)phenylisothiocyanat
CGP 4540
C 9333 GO
4-Isothiocyanato-N-(4-nitrophenyl)benzenamine
GO 9333
X0MK46CVRB
CHEBI:38944
ISOTHIOCYANIC ACID, p-(p-NITROANILINO)PHENYL ESTER
DTXSID90180946
nithiocyanamine
RefChem:112258
DTXCID30103437
C-9333-Go
CGP-4540
100990-46-3
Amoscanate [INN]
CGP4540
CGP4540(Amoscanate)
Amoscanate; C 9333Go; CGP 4540; CIBA 9333Go
Benzen-t-amine, 4-isothiocyanato-N-(4-nitrophenyl)-
Benzenamine, 4-isothiocyanato-N-(4-nitrophenyl)- (9CI)
Amoscanatum [INN-Latin]
Amoscanato [INN-Spanish]
UNII-X0MK46CVRB
4-Isothiocyano-4'-nitro diphenylamine
BRN 0888705
Benzenamine, 4-isothiocyanato-N-(4-nitrophenyl)-
AMOSCANATE [MI]
CGP4540(Amoscanate)?
AMOSCANATE [MART.]
(4-Isothiocyanato-phenyl)-(4-nitrophenyl)amine
orb422396
CHEMBL93385
SCHEMBL159478
orb1703738
GLXC-15403
AKOS040745560
AA183407
DA-72126
MS-23840
4-Isothiocyanato-N-(4-nitrophenyl)-aniline
HY-129051
CS-0103323
NS00121034
G12674
Q4747973