Phenyl isocyanide(CAS: 931-54-4)

CAS Number
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Basic Information
Molecular Formula
C7H5N
Molecular Weight
12.01 g/mol
Physical Properties
Boiling Point
183.35°C (rough estimate)
Density
1.0248 (rough estimate)
Chemical Identifiers
SMILES
[C-]#[N+]C1=CC=CC=C1
InChIKey
RCIBIGQXGCBBCT-UHFFFAOYSA-N
Database References
MDL Number
MFCD05148520
FAQ
Phenyl isocyanide (CAS: 931-54-4) is a colorless to yellowish liquid with a pungent odor. Its molecular weight is approximately 123.14 g/mol. It has a limited solubility in water but is highly soluble in organic solvents. Phenyl isocyanide is known to react with amines and water to form ureas and carbamates. It is also readily polymerized under certain conditions.
Phenyl isocyanide can be synthesized by the reaction of phenyl isothiocyanate with sodium hydroxide, followed by acidification to form phenyl isocyanide. The reaction is typically carried out in a water medium, and the yield is around 80-85%. This method uses sodium hydroxide as a catalyst and requires appropriate safety measures to handle the strong base and the subsequent acidification step.
Phenyl isocyanide (CAS: 931-54-4) is primarily used in the pharmaceutical industry for the synthesis of various compounds, including biologically active molecules. It is also used in the polymer industry for the production of polyurethane-based materials. Additionally, it has applications in the development of sensors and semiconductors due to its reactive nature.
When handling phenyl isocyanide (CAS: 931-54-4), it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. Spills should be handled with appropriate absorbent materials, and the area should be cleaned thoroughly. Always consult the Safety Data Sheet (SDS) for detailed information on handling and storage procedures.
Safety Notice
Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.
Always follow proper handling procedures
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