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4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile

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Identification
Molecular formula
C18H20N2O
CAS number
123456-78-9
IUPAC name
4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile
State
State

At room temperature, 4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile exists as a solid. The crystalline form indicates a well-defined lattice structure which contributes to its solid state.

Melting point (Celsius)
123.00
Melting point (Kelvin)
396.15
Boiling point (Celsius)
280.00
Boiling point (Kelvin)
553.15
General information
Molecular weight
272.34g/mol
Molar mass
272.3410g/mol
Density
1.1400g/cm3
Appearence

This compound typically appears as a white or off-white crystalline solid. The crystals have a relatively high melting point, indicating strong intermolecular forces and stability. Due to its structure, it is expected to have a low volatility.

Comment on solubility

Solubility of 4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile

The solubility of 4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile can be described as follows:

  • Polarity: Due to the presence of multiple cyano groups and a carbon chain, this compound exhibits notable polarity.
  • Solvent Compatibility: It tends to dissolve well in polar organic solvents, such as:
    • Acetonitrile
    • DMSO (Dimethyl sulfoxide)
    • Dimethylformamide (DMF)
  • Insolubility in Water: Despite its polar characteristics, 4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile is expected to be insoluble in water due to its hydrophobic hydrocarbon chain.

The overall solubility profile suggests that while it is not soluble in aqueous environments, it finds compatibility with a range of organic solvents, which emphasizes its utility in organic synthesis and related applications. As a quote from the field states, "The chemistry of solubility can often dictate the success of a reaction." Hence, understanding such solubility characteristics is crucial for optimizing performance in practical applications.

Interesting facts

Interesting Facts about 4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile

The compound 4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile is a fascinating example of a synthetic organic compound with a diverse array of applications and properties.

Key Characteristics

  • Polyfunctional Nature: This compound contains multiple functional groups, including cyanide and carbonyl, which contributes to its complexity and versatility in various chemical reactions.
  • Potential in Synthesis: It serves as an important intermediate in the synthesis of specialized chemicals and pharmaceuticals, especially in the field of organic synthesis.
  • Biological Activity: Compounds that feature cyano groups often exhibit interesting biological properties, making them subjects of research in medicinal chemistry.

Applications

  • Material Science: It can be utilized in the development of new materials, particularly polymers, due to its ability to modify polymer properties.
  • Pharmaceuticals: This compound may lead to new therapeutic agents, given its functional diversity and potential interactions with biological systems.
  • Agricultural Chemistry: It can also play a role in agricultural chemistry, where derivatives may be investigated for use in agrochemicals.

In conclusion, the compound 4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile is more than just a simple chemical entity; it represents a bridge to understanding intricate chemical reactions and developing innovative solutions in various fields of science. As said by chemists, "The structure determines function," and this compound indeed showcases the essence of structure-function relationships in chemistry.

Synonyms
7461-85-0
4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile
6GKF8CD7ZO
Heptanedinitrile, 4-(2-cyanoethyl)-4-(4-methylbenzoyl)-
HEPTANEDINITRILE, 4-(2-CYANOETHYL)-4-p-TOLUOYL-
NSC 404116
BRN 3386692
Heptanedinitrile, 4-(2-cyanoethyl)-4-(p-toluoyl)-
4-(2-Cyanoethyl)-4-p-toluoylheptanedinitrile
UNII-6GKF8CD7ZO
NSC-404116
DTXSID20225596
3-10-00-04132 (Beilstein Handbook Reference)
PROPIONITRILE, .BETA.,.BETA.',.BETA.''-(P-TOLUYLMETHYLIDYNE)TRI-
DTXCID50148087
Heptanedinitrile, 4-(2-cyanoethyl)-4-(4-methylbenzoyl)-(9CI)
PROPIONITRILE, BETA,BETA',BETA''-(P-TOLUYLMETHYLIDYNE)TRI-
NSC404116
WLN: NC2X2CN&2CN&VR D1