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3-acetyl-1H-indole-5-carbonitrile

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Identification
Molecular formula
C11H8N2O
CAS number
<p>Perform a thorough search in a reliable chemical database for this compound to obtain the CAS number, as it is not commonly found in typical data resources.</p>
IUPAC name
3-acetyl-1H-indole-5-carbonitrile
State
State

At room temperature, 3-acetyl-1H-indole-5-carbonitrile is typically in a solid state, appearing as fine crystals or powder.

Melting point (Celsius)
146.00
Melting point (Kelvin)
419.15
Boiling point (Celsius)
368.10
Boiling point (Kelvin)
641.25
General information
Molecular weight
196.21g/mol
Molar mass
196.2130g/mol
Density
1.2140g/cm3
Appearence

3-acetyl-1H-indole-5-carbonitrile is generally found as a solid crystalline substance. It typically appears as a pale yellow to off-white powder, depending on the purity and specific manufacturing process.

Comment on solubility

Solubility of 3-acetyl-1H-indole-5-carbonitrile

3-acetyl-1H-indole-5-carbonitrile is known for its intriguing solubility profile. The solubility of this compound can be influenced by various factors, including temperature, solvent polarity, and the presence of functional groups. Here are some key points regarding its solubility:

  • Solvent Compatibility: This compound is generally soluble in organic solvents such as dimethyl sulfoxide (DMSO) and dimethylformamide (DMF), but less soluble in non-polar solvents.
  • Temperature Dependency: Like many organic compounds, the solubility of 3-acetyl-1H-indole-5-carbonitrile increases with temperature, demonstrating greater dissolution at higher temperatures due to enhanced molecular motion.
  • Hydrogen Bonding: The presence of a carbonitrile group can engage in hydrogen bonding, which contributes to its solubility in polar solvents.
  • pH Influence: The solubility may also vary with pH, as ionization of functional groups can alter the compound's interaction with the solvent.

In summary, while 3-acetyl-1H-indole-5-carbonitrile may exhibit limited solubility in water, it shows promising solubility characteristics in various organic solvents, making it suitable for applications in pharmaceutical and chemical research. As noted, understanding the solubility behavior is crucial for optimizing its use in different chemical contexts.

Interesting facts

Interesting Facts About 3-acetyl-1H-indole-5-carbonitrile

3-acetyl-1H-indole-5-carbonitrile is a fascinating compound that belongs to the indole family, which is well-known for its various biological activities. Here are some interesting aspects of this compound:

  • Structure and Function: The structure of 3-acetyl-1H-indole-5-carbonitrile features a unique arrangement of an indole ring, an acetyl group, and a carbonitrile functional group. This combination imparts significant chemical reactivity and offers potential applications in different fields including pharmaceuticals.
  • Biological Significance: Indole derivatives have been extensively studied for their role in medicinal chemistry. Compounds like 3-acetyl-1H-indole-5-carbonitrile exhibit various biological activities such as anti-inflammatory, antibacterial, and anticancer properties, making them valuable in drug discovery.
  • Synthesis Routes: The synthesis of this compound can involve multiple methods, often utilizing precursor indoles and introducing the carbonitrile and acetyl groups through reactions such as electrophilic aromatic substitution. This versatility in synthetic routes is an attractive feature for chemists looking to explore its properties.
  • Research Potential: Due to its unique functional groups, 3-acetyl-1H-indole-5-carbonitrile continues to be an object of research. Studying this compound could lead to the discovery of new therapeutic agents, underscoring the importance of indole-based compounds in modern medicinal chemistry.

Overall, 3-acetyl-1H-indole-5-carbonitrile represents a captivating example of how seemingly simple molecular structures can hold immense potential in diverse areas of science and technology.

Synonyms
17380-19-7
INDOLE-5-CARBONITRILE, 3-ACETYL-
3-Acetylindole-5-carbonitrile
5-Cyano-3-indolylmethyl ketone
BRN 0391186
DTXSID60169662
5-22-06-00327 (Beilstein Handbook Reference)
DTXCID1092153
3-acetyl-1H-indole-5-carbonitrile
3-Acetyl-indole-5-carbonitrile
SCHEMBL6879221