CAS 629-79-8
:Hexadecanenitrile
Description:
Hexadecanenitrile, also known as cetyl nitrile, is a long-chain aliphatic nitrile with the chemical formula C16H33CN. It is characterized by a straight-chain structure consisting of a 16-carbon alkyl chain terminated by a nitrile functional group (-C≡N). This compound is typically a colorless to pale yellow liquid or solid at room temperature, depending on its purity and specific conditions. Hexadecanenitrile is insoluble in water but soluble in organic solvents such as ethanol and ether, which is common for long-chain fatty nitriles. It has applications in various fields, including organic synthesis, as a precursor for surfactants, and in the production of lubricants and plasticizers. Additionally, hexadecanenitrile can serve as a useful intermediate in the synthesis of other organic compounds. Its properties, such as melting point, boiling point, and density, are influenced by its long hydrocarbon chain, which contributes to its hydrophobic nature. Safety precautions should be taken when handling this compound, as with many nitriles, due to potential toxicity and irritant effects.
Formula:C16H31N
InChI:InChI=1S/C16H31N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-15H2,1H3
InChI key:InChIKey=WGXGAUQEMYSVJM-UHFFFAOYSA-N
SMILES:C(CCCCCCCC)CCCCCCC#N
Synonyms:- Palmitic acid nitrile
- Hexadecanenitrile
- Palmitonitrile
- NSC 2137
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