5-Fluoro-1-benzothiophene(CAS: 70060-12-7)

CAS Number
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Basic Information
Molecular Formula
C8H5FS
Molecular Weight
152.19 g/mol
Physical Properties
Boiling Point
59-61 ºC (2 Torr)
Density
1.298±0.06 g/cm3 (20 ºC 760 Torr),
Flash Point
90.6±19.8 ºC,
Chemical Identifiers
SMILES
C1=CC2=C(C=CS2)C=C1F
InChIKey
VKBPSLNJNKFVAC-UHFFFAOYSA-N
Database References
MDL Number
MFCD11110411
FAQ
5-Fluoro-1-benzothiophene is a colorless or light yellow crystalline solid with a molecular weight of approximately 162.07 g/mol. It has a low solubility in water (0.02 g/100 mL at 20°C) but is more soluble in organic solvents like ethanol and acetone. The compound exhibits moderate reactivity, particularly towards nucleophiles and electrophiles, and it is often used in organic synthesis due to its unique electronic properties.
5-Fluoro-1-benzothiophene can be synthesized via the halo substitution of 1-benzothiophene with hydrogen fluoride (HF) in the presence of a suitable catalyst such as iron trifluoromethanesulfonate. The reaction conditions typically involve heating the mixture to 100°C under an inert atmosphere. This method provides good yield and selectivity for the substitution product.
5-Fluoro-1-benzothiophene is primarily used in the pharmaceutical industry as a precursor for the synthesis of drugs with anti-inflammatory and analgesic properties. It also finds applications in the polymer industry for the development of functional polymers with enhanced electronic properties. Additionally, it is used in the production of sensors and semiconductors due to its unique chemical and electronic characteristics.
When handling 5-Fluoro-1-benzothiophene, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to avoid inhalation of vapors. In the event of a spill, it should be carefully cleaned up using absorbent materials, and the area should be well-ventilated. Detailed safety data sheets (SDS) should be consulted for specific handling and disposal guidelines.
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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