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3-Phenyl-5-(trichloromethyl)-1,2,4-oxadiazole

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Identification
Molecular formula
C9H5Cl3N2O
CAS number
3307-34-4
IUPAC name
3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole
State
State

At room temperature, 3-Phenyl-5-(trichloromethyl)-1,2,4-oxadiazole is in a solid state, typically manifesting as a crystalline powder. Its stability in this form is crucial for handling and application in various chemical processes.

Melting point (Celsius)
92.00
Melting point (Kelvin)
365.15
Boiling point (Celsius)
341.00
Boiling point (Kelvin)
614.15
General information
Molecular weight
246.51g/mol
Molar mass
246.5110g/mol
Density
1.5300g/cm3
Appearence

3-Phenyl-5-(trichloromethyl)-1,2,4-oxadiazole typically appears as a light yellow crystalline powder. Its distinct structure is characterized by the presence of both aromatic and heterocyclic components, contributing to its chemical properties.

Comment on solubility

Solubility of 3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole

The solubility of 3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole can be described as relatively low in aqueous environments due to its hydrophobic trichloromethyl group. This compound typically exhibits:

  • Poor solubility in water: The presence of the bulky, electron-withdrawing trichloromethyl group influences the overall polarity, making it less soluble in polar solvents like water.
  • Higher solubility in organic solvents: Compounds similar to 3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole are often more soluble in non-polar organic solvents such as chloroform, benzene, and ethyl acetate.

In general, the solubility characteristics can be summarized with the following key points:

  1. Solubility in water: Poor
  2. Solubility in organic solvents: Good to Moderate

As a result, careful consideration of the solvent choice is essential when working with this compound in laboratory settings or applications to ensure effective dissolution and interaction with other substances. Remember, the molecular structure plays a critical role in determining solubility!

Interesting facts

Interesting Facts about 3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole

3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole is a fascinating compound that attracts attention in various fields of chemistry due to its unique structural characteristics and potential applications.

Structure and Properties

  • Oxadiazole Ring: This compound features an oxadiazole ring, which enhances its stability and reactivity, making it an interesting subject for research.
  • Trichloromethyl Group: The presence of a trichloromethyl group (-CCl3) is notable, as it can impact the compound’s reactivity and properties significantly, influencing its behavior in various chemical reactions.
  • Phenyl Substitution: The phenyl group contributes to the compound's overall electronic characteristics, potentially improving its ability to interact with biological systems.

Applications & Importance

This compound has garnered interest for several reasons:

  • Pesticide Development: Due to its unique structure, it shows promise in the development of agrochemicals, particularly in the creation of new pesticide formulations.
  • Pharmaceutical Research: Compounds like 3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole are often investigated for their potential biological activities, which may include antimicrobial or anti-cancer effects.
  • Material Science: The stability offered by the oxadiazole structure could make it useful in developing advanced materials, especially in electronics and optics.

Research Perspectives

As a chemist or student, exploring 3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole opens doors to:

  • Innovation in synthetic methodologies for creating heterocyclic compounds.
  • Understanding structure-activity relationships in drug design.
  • Developing a knowledge base on the impact of halogenated compounds in biological systems.

In conclusion, 3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole provides a compelling example of how structural nuances can lead to significant implications in chemistry, biology, and materials science. Its study not only furthers scientific knowledge but also fuels empirical advancements.

Synonyms
1208-05-5
BRN 0525816
3-Phenyl-5-trichloromethyl-1,2,4-oxadiazole
1,2,4-OXADIAZOLE, 3-PHENYL-5-TRICHLOROMETHYL-
DTXSID70153012
DTXCID7075503
3-phenyl-5-(trichloromethyl)-1,2,4-oxadiazole
C9H5Cl3N2O
SCHEMBL3634573
DYLKAZGGQBPFEM-UHFFFAOYSA-N
BAA20805
3-phenyl-5-trichloromethyl-[1,2,4]oxadiazole
EN300-155541