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S-phenyl 4-nitrobenzenecarbothioate

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Identification
Molecular formula
C13H9NO3S
CAS number
16357-24-9
IUPAC name
S-phenyl 4-nitrobenzenecarbothioate
State
State

At room temperature, S-phenyl 4-nitrobenzenecarbothioate is in a solid state as it is a crystalline compound.

Melting point (Celsius)
111.00
Melting point (Kelvin)
384.15
Boiling point (Celsius)
405.20
Boiling point (Kelvin)
678.35
General information
Molecular weight
275.32g/mol
Molar mass
275.3160g/mol
Density
1.3300g/cm3
Appearence

S-phenyl 4-nitrobenzenecarbothioate typically appears as a yellow crystalline solid.

Comment on solubility

Solubility of S-phenyl 4-nitrobenzenecarbothioate

S-phenyl 4-nitrobenzenecarbothioate has a rather intriguing solubility profile that is of considerable interest in both industrial and research applications. Its solubility can be influenced by various factors such as temperature, pH, and the presence of other solvents. Here are some key points to consider:

  • Polarity: As a relatively polar compound due to the presence of the nitro group (–NO2), it demonstrates increased solubility in polar solvents such as water and alcohols.
  • Solvent Choice: Typically, S-phenyl 4-nitrobenzenecarbothioate exhibits better solubility in organic solvents such as ethanol and acetone, while its solubility in non-polar solvents is considerably lower.
  • Temperature Influence: Increased temperature often enhances solubility, particularly in solid-state forms, making it easier to dissolve in a solvent.
  • pH Sensitivity: Changes in pH can affect the ionization state of the compound, which in turn influences its solubility in aqueous solutions.

In summary, the solubility of S-phenyl 4-nitrobenzenecarbothioate is influenced by a variety of factors, making understanding its solubility crucial for effective application and use in chemical processes. Awareness of the interactions with different solvents is key to optimizing its use.

Interesting facts

Interesting Facts about S-phenyl 4-nitrobenzenecarbothioate

S-phenyl 4-nitrobenzenecarbothioate is a fascinating compound that demonstrates the diverse chemistry of thioesters, providing a unique glimpse into the world of synthetic organic chemistry. Here are some noteworthy aspects of this compound:

  • Structural Complexity: This compound features a complex structure that includes both a thiol and an aromatic system, showcasing the intriguing properties of thioester linkages.
  • Applications in Synthesis: S-phenyl 4-nitrobenzenecarbothioate is utilized in various organic synthesis reactions, making it a valuable tool for chemists looking to create more complex molecules.
  • Role in Medicinal Chemistry: Thioesters, including this compound, often serve as intermediates in the development of pharmaceuticals, highlighting their significance in drug discovery.
  • Reactivity: The presence of the nitro group (-NO₂) on the aromatic ring significantly influences the reactivity of the compound, making it a subject of interest in both chemical studies and industrial applications.
  • Chemical Properties: The thioester functionality is key to its reactivity in various transformations, including acylation reactions and the formation of more complex molecular architectures.

As a unique example of thioester chemistry, S-phenyl 4-nitrobenzenecarbothioate embodies the creativity found within the field of organic chemistry. Understanding its properties and reactivity can lead to advancements in both synthetic methodologies and the development of new materials.

Synonyms
S-Phenyl p-nitrothiobenzoate
3128-43-6
BENZOIC ACID, p-NITROTHIO-, S-PHENYL ESTER
S-phenyl 4-nitrobenzenecarbothioate
NSC 57941
BRN 2280611
Benzenecarbothioic acid, 4-nitro-, S-phenyl ester
WLN: WNR DVSR
NCIOpen2_002410
S-phenyl 4-nitrobenzothioate
4-09-00-01398 (Beilstein Handbook Reference)
Benzoic acid, S-phenyl ester
DTXSID60185201
NSC57941
NSC-57941
4-Nitro-thiobenzoic acid S-phenyl ester