4-Chlorobenzenesulfonyl isocyanate(CAS: 5769-15-3)

CAS Number
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Basic Information
Molecular Formula
C7H4ClNO3S
Molecular Weight
217.63 g/mol
Physical Properties
Boiling Point
121 °C/0.5 mmHg(lit.)
Chemical Identifiers
SMILES
C1=CC(=CC=C1S(=O)(=O)N=C=O)Cl
InChIKey
JGHDVROWMPBQSR-UHFFFAOYSA-N
Database References
MDL Number
MFCD00009978
Beilstein Registry Number
516520
FAQ
4-Chlorobenzenesulfonyl isocyanate is a white crystalline solid with a molecular weight of approximately 232.6 g/mol. It is slightly soluble in water but soluble in organic solvents such as methanol and acetone. This compound is highly reactive, featuring a sulfonyl chloride and an isocyanate group, making it suitable for a variety of chemical reactions.
4-Chlorobenzenesulfonyl isocyanate is typically synthesized via the reaction of 4-chlorobenzenesulfonyl chloride with phosgene. This process is conducted under anhydrous conditions using a suitable solvent such as toluene. The reaction is known to be highly effective and selective, yielding the target compound with a good yield.
4-Chlorobenzenesulfonyl isocyanate finds applications in pharmaceuticals, where it is used as a precursor for the synthesis of certain drugs. It is also utilized in the production of polymers, sensors, and semiconductors due to its reactivity with a variety of functional groups.
When handling 4-Chlorobenzenesulfonyl isocyanate, safety measures should include the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a fume hood to minimize exposure. In case of spill, the area should be carefully cleaned up using appropriate absorbents, and the incident should be reported to the appropriate authorities. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.
Safety Notice
Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.
Always follow proper handling procedures
Contact Information
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