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7-Nitro-4-(phenylsulfanyl)-2,1,3-benzoxadiazole

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Identification
Molecular formula
C12H7N3O3S
CAS number
183797-64-6
IUPAC name
7-nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole
State
State

At room temperature, 7-nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole is a solid with a crystalline structure.

Melting point (Celsius)
118.00
Melting point (Kelvin)
391.15
Boiling point (Celsius)
364.00
Boiling point (Kelvin)
637.15
General information
Molecular weight
287.29g/mol
Molar mass
287.2860g/mol
Density
1.5062g/cm3
Appearence

This compound is typically a pale yellow crystalline solid. The crystalline nature contributes to its defined geometry which is crucial in applications like fluorescent studies due to its colorimetric properties.

Comment on solubility

Solubility of 7-nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole

The solubility of 7-nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole is a fascinating aspect worth exploring. This compound exhibits selective solubility characteristics influenced by various factors:

  • Polarity: Being a somewhat polar molecule, it demonstrates solubility in polar solvents such as dimethyl sulfoxide (DMSO) and ethanol.
  • Hydrophobic Interactions: The presence of the phenylsulfanyl group may hinder solubility in highly polar solvents, implying potential challenges when mixed with water.
  • Chemical Structure: The specific benzoxadiazole structure contributes to its overall solubility behavior; the positioning of nitro and sulfanyl groups can create unique interactions with solvent molecules.

It is essential to note that the solubility may vary with temperature and concentration, and thus, understanding these variations can provide insights into its practical applications:

  1. In solution, 7-nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole can yield interesting chemical reactions due to its intermediates.
  2. Testing in various solvents can illuminate the diverse functional forms of the compound, further informing synthesis strategies.

In conclusion, while 7-nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole shows promise in certain solvents, further experimental validation is crucial to determine its behavior in various mixtures.

Interesting facts

Interesting Facts about 7-Nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole

7-Nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole is a fascinating compound that belongs to the family of benzoxadiazoles, known for their wide range of applications in various fields of research. Here are some intriguing insights:

  • Versatile Applications: Due to its unique structure, this compound is often utilized in the field of fluorescent markers and photodynamic therapy, showcasing its potential in medical diagnostics and treatment.
  • Fluorescent Properties: The nitro group and the benzothiadiazole segment contribute to enhanced fluorescent properties, making it an ideal candidate for use in biological imaging and sensor technology.
  • Research Interest: Scientists are deeply interested in the behavior and interactions of this compound because it may lead to the development of innovative pharmaceutics and diagnostic tools that target specific biological processes.
  • Environmental Applications: Beyond the biological field, compounds like 7-nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole are studied for their potential roles in environmental monitoring, particularly in tracking pollutant levels in water.
  • Structure-Activity Relationship: The compound serves as a crucial focal point for studies aimed at understanding the structure-activity relationship (SAR) in related compounds, guiding the design of new drugs with enhanced efficacy and reduced side effects.

As research continues to unveil the complex characteristics of 7-nitro-4-phenylsulfanyl-2,1,3-benzoxadiazole, its multifaceted nature undoubtedly positions it as a key player in advancing both scientific knowledge and practical applications.

Synonyms
7-nitro-4-(phenylthio)benzofurazan
NBF-SPh
16322-23-9
Benzofurazan, 4-nitro-7-(phenylthio)-
4-Nitro-7-phenylthiobenzofurazan
BENZOFURAZAN, 4-NITRO-7-PHENYLTHIO-
MLW3MG733L
CHEMBL2430537
NSC-228145
NSC 228145
BRN 1006040
NSC228145
UNII-MLW3MG733L
SCHEMBL6836307
DTXSID30167539
BDBM50038324
PD082815