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3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile

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Identification
Molecular formula
C13H15NO2S
CAS number
165501-59-5
IUPAC name
3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile
State
State

3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile is typically found in solid state at room temperature. It has a crystalline form and is usually stable under standard storage conditions.

Melting point (Celsius)
108.00
Melting point (Kelvin)
381.15
Boiling point (Celsius)
320.00
Boiling point (Kelvin)
593.15
General information
Molecular weight
263.34g/mol
Molar mass
263.3370g/mol
Density
1.2163g/cm3
Appearence

3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile is a white crystalline solid. It is usually supplied in powdered form and may appear slightly off-white depending on the purity and handling conditions.

Comment on solubility

Solubility of 3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile (C13H15NO2S)

The solubility of 3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile can be an intriguing aspect of its chemical behavior. In general, the solubility of a compound is influenced by various factors such as polarity, hydrogen bonding, and the presence of functional groups. Here are some key considerations regarding its solubility:

  • Polarity: This compound contains both hydrophobic (the tert-butyl group) and polar (the sulfonyl and nitrile groups) elements, which may lead to moderate solubility in organic solvents.
  • Solvent Compatibility: It is likely to be more soluble in non-polar solvents such as toluene or hexane, but less soluble in polar solvents like water.
  • Functional Groups: The presence of the sulfonyl group (-SO2-) suggests potential interactions with polar solvents, which could enhance solubility under certain conditions.
  • Temperature Effect: Solubility may increase with temperature, which is often the case for many organic compounds.

In conclusion, while 3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile demonstrates characteristics that suggest it might be soluble in various organic solvents, its specific solubility should be assessed experimentally to determine the exact behavior in different environments. As a general rule, compounds featuring both hydrophobic and polar groups can exhibit complex solubility patterns, leading to intriguing behaviors in solution.

Interesting facts

Facts about 3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile

3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile is a compound of significant interest in organic chemistry due to its unique structural features and potential applications. Below are some intriguing points about this intriguing molecule:

  • Functional Diversity: This compound contains multiple functional groups, such as a sulfonyl group and a nitrile group, which contribute to its reactivity and versatility in chemical reactions.
  • Applications in Synthesis: The presence of the vinyl group (prop-2-ene) is particularly beneficial in organic synthesis, as it can participate in various addition reactions, making it valuable in the development of new compounds.
  • Pharmaceutical Potential: Compounds with sulfonyl groups have shown promising activity in the pharmaceutical industry, often acting as bioisosteres for carboxylic acids, which can enhance the drug's bioavailability.
  • Aromatic Character: The 4-tert-butylphenyl moiety provides steric effects that can influence the compound’s solubility, reactivity, and interaction with biological systems, opening doors to various applications in medicinal chemistry.
  • Research Support: Ongoing research into compounds with similar structures suggests they may play roles in developing new materials, catalysts, or therapeutic agents, which highlights the importance of studying such molecules.

In conclusion, the structure of 3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile, with its diverse functional groups, offers a fascinating landscape for chemical exploration and applications. As scientists continue to investigate its properties and potential utilizations, it remains a key compound in organic and medicinal chemistry.

Synonyms
(2E)-3-(4-TERT-BUTYLBENZENESULFONYL)PROP-2-ENENITRILE
AKOS026750273
DA-35183
3-(4-tert-butylphenyl)sulfonyl-2-propenenitrile
Q27185976