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4-Acetyl-4-(2-cyanoethyl)heptanedinitrile

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Identification
Molecular formula
C13H17N3O
CAS number
50523-66-9
IUPAC name
4-acetyl-4-(2-cyanoethyl)heptanedinitrile
State
State

At room temperature, 4-Acetyl-4-(2-cyanoethyl)heptanedinitrile exists in a solid state. Due to its crystalline structure, it maintains its form unless subjected to temperatures near its melting point. The material exhibits a stable form that requires certain conditions for altering its phase or decomposition.

Melting point (Celsius)
82.00
Melting point (Kelvin)
355.20
Boiling point (Celsius)
350.50
Boiling point (Kelvin)
623.70
General information
Molecular weight
219.30g/mol
Molar mass
219.2700g/mol
Density
1.0250g/cm3
Appearence

4-Acetyl-4-(2-cyanoethyl)heptanedinitrile is a solid compound that generally appears as a crystalline powder. It is typically white to off-white in color, but subtle variations in purity and synthesis conditions can affect its shade slightly. The substance is relatively stable under standard conditions and should be handled with care to avoid decomposition.

Comment on solubility

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

The solubility of 4-acetyl-4-(2-cyanoethyl)heptanedinitrile, a complex organic molecule, can vary based on several environmental factors and the solvent in question.

Here are some key points regarding its solubility:

  • Polar Solvents: The presence of multiple cyano (-CN) groups suggests that this compound may exhibit some degree of solubility in polar solvents, such as water or alcohols, due to dipole interactions.
  • Nonpolar Solvents: Conversely, nonpolar solvents may show limited solubility due to the compound's polar functional groups dominating its behavior.
  • Temperature Effects: Solubility can significantly increase with temperature; thus, heating the solvent may enhance the dissolution process.
  • Concentration Factors: The solubility may depend on the concentration of the solution, with higher concentrations potentially leading to precipitation if the solubility limit is surpassed.

In conclusion, while the solubility of 4-acetyl-4-(2-cyanoethyl)heptanedinitrile can be influenced by various factors as mentioned, conducting empirical solubility tests in different media is essential for a thorough understanding. Remember, "solubility is a fascinating dance between molecules," as it reflects their interactions under various conditions.

Interesting facts

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

The compound 4-acetyl-4-(2-cyanoethyl)heptanedinitrile is a remarkable organic molecule known for its versatile applications in synthetic chemistry. As a member of the nitrile family, it showcases unique characteristics that can spark the interest of chemists and researchers alike.

Key Characteristics

  • Diverse Applications: This compound serves as a crucial building block in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals.
  • Synthetic Utility: Its ability to undergo various reactions, such as nucleophilic additions and cycloadditions, makes it valuable in creating complex chemical structures.
  • Cytotoxicity and Antitumor Potential: Research has indicated that compounds with cyano groups can exhibit cytotoxic properties, making them of interest in cancer research.

Moreover, 4-acetyl-4-(2-cyanoethyl)heptanedinitrile showcases the intriguing interplay between molecular structure and reactivity. The presence of both acetyl and nitrile functional groups provides a platform for a range of chemical transformations, thus enhancing its utility in medicinal chemistry.

Innovative Research

Scientists are actively exploring the potential implications of this compound in cutting-edge research areas. For instance, it could be a precursor to:

  • Novel drug candidates
  • Biologically active compounds
  • Advanced materials with unique properties

As a chemistry student or scientist, one might say: "The exploration of nitrile compounds opens doors to uncharted territories in chemical synthesis." The journey of unraveling the full potential of 4-acetyl-4-(2-cyanoethyl)heptanedinitrile is just beginning, promising exciting discoveries on the horizon.

Synonyms
4-Acetyl-4-(2-cyanoethyl)heptanedinitrile
126-50-1
1,1,1-Tris(2-cyanoethyl)acetone
USAF B-122
M2YBH5Y6K7
NSC 147707
1,1,1-Tris(2-cyanoethyl)-2-propanone
4-Acetyl-4-(2cyanoethylheptane)dinitrile
Heptanedinitrile, 4-acetyl-4-(2-cyanoethyl)-
NSC-147707
NSC-680511
MFCD01723843
NSC680511
1,7-HEPTANEDINITRILE, 4-ACETYL-4-(2-CYANOETHYL)-
EINECS 204-787-3
1,1,1-Tris(beta-cyanoethyl)acetone
BRN 1782506
Heptane, 4-acetyl-4-(2-cyanoethyl)-1,7-dinitrilo-
NSC147707
Heptane,7-dinitrilo-
starbld0011199
RefChem:1070208
UNII-M2YBH5Y6K7
1,1-Tris-cyanoethylacetone
3-03-00-01439 (Beilstein Handbook Reference)
1,1-Tris(2-cyanoethyl)acetone
SCHEMBL11509637
DTXSID90155038
JEQZAEPYFGSAIF-UHFFFAOYSA-N
1, 4-acetyl-4-(2-cyanoethyl)-
1,1-Tris(.beta.-cyanoethyl)acetone
1,1-Tris(2-cyanoethyl)-2-propanone
AKOS024254548
1,1,1-Tris(.beta.-cyanoethyl)acetone
WLN: NC2XV1 & 2CN & 2CN
NS-02534
NS00041633
204-787-3