3-(Trifluoromethyl)thiophenol(CAS: 937-00-8)

CAS Number
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Basic Information
Molecular Formula
C7H5F3S
Molecular Weight
178.18 g/mol
Physical Properties
Boiling Point
163°C(lit.)
Density
1.314
Flash Point
71-72°C/20mm
Chemical Identifiers
SMILES
C1=CC(=CC(=C1)S)C(F)(F)F
InChIKey
SCURCOWZQJIUGR-UHFFFAOYSA-N
Database References
MDL Number
MFCD00041142
Beilstein Registry Number
1943114
FAQ
3-(Trifluoromethyl)thiophenol (CAS: 937-00-8) is a colorless to yellow liquid with a molecular weight of approximately 194.07 g/mol. It has a moderate solubility in water but is highly soluble in organic solvents. It is known for its high reactivity, particularly in electrophilic substitution reactions. Its crystalline form has a melting point around 118-120°C. This compound is often used in organic synthesis due to its reactivity and stability in functional group transformations.
3-(Trifluoromethyl)thiophenol can be synthesized through various routes, commonly involving the bromination of thiophenol followed by nucleophilic substitution with trifluoromethyl sulfide. This process requires strict control of reaction conditions to achieve high selectivity and yield. Specific catalysts such as sodium hydride or potassium tert-butoxide have been used to enhance the reaction’s efficiency and product purity.
3-(Trifluoromethyl)thiophenol (CAS: 937-00-8) is primarily used in the pharmaceutical industry for the synthesis of drugs, as well as in polymer chemistry to improve material properties. It is also utilized in sensor technology for detecting specific gases and in semiconductor applications for etching processes. Its unique chemical structure and reactivity make it invaluable in these specialized fields.
When handling 3-(Trifluoromethyl)thiophenol (CAS: 937-00-8), it is essential to use personal protective equipment (PPE) such as gloves, safety goggles, and a laboratory coat. This compound should be used in a well-ventilated fume hood to minimize exposure. Proper spill management procedures must be in place, and the safety data sheet (SDS) should be consulted for detailed emergency response guidelines. Handling should be conducted with caution due to its reactivity and potential for causing skin and eye irritation.
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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