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4-(Bromomethyl)-3-fluorobenzonitrile(CAS: 105942-09-4)

4-(Bromomethyl)-3-fluorobenzonitrile
CAS Number

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Basic Information

Molecular Formula
C8H5BrFN
Molecular Weight
214.03 g/mol
Physical State
Pale-yellow to Yellow-brown Solid

Physical Properties

Melting Point
75.0 to 79.0 deg-C
Boiling Point
276.4℃ at 760 mmHg
Density
1.59
Flash Point
121℃

Chemical Identifiers

SMILES
C1=CC(=C(C=C1C#N)F)CBr
InChIKey
ZESZAIOGACKOMB-UHFFFAOYSA-N

Database References

MDL Number
MFCD07368341

FAQ

4-(Bromomethyl)-3-fluorobenzonitrile (CAS: 105942-09-4) is a crystalline compound with a molecular weight of approximately 216.03 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and chloroform. This compound is chemically reactive, particularly towards nucleophiles and reducing agents. It is often used in organic synthesis due to its bromomethyl group and fluorine substituent.
4-(Bromomethyl)-3-fluorobenzonitrile (CAS: 105942-09-4) is typically synthesized through a multistep process involving the bromination of 3-fluorobenzonitrile followed by alkylation. The reaction is often catalyzed by a Lewis acid like aluminum bromide (AlBr₃) and can be carried out in a solvent such as chloroform. The yield and selectivity are influenced by the reaction conditions and the choice of catalyst.
4-(Bromomethyl)-3-fluorobenzonitrile (CAS: 105942-09-4) is primarily used in pharmaceutical and polymer industries. It serves as an intermediate in the synthesis of various drugs and polymers. Additionally, it can be used in the development of sensors and semiconductors due to its chemical reactivity and functional groups.
When handling 4-(Bromomethyl)-3-fluorobenzonitrile (CAS: 105942-09-4), it is essential to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or under a fume hood to minimize exposure to vapors. Spills should be cleaned up using appropriate chemicals and methods described in the safety data sheet (SDS). Always refer to the SDS for detailed safety information and emergency 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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