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4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)isoquinoline(CAS: 844891-01-6)

4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)isoquinoline
CAS Number

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Basic Information

Molecular Formula
C14H16BNO2
Molecular Weight
241.1 g/mol

Physical Properties

Melting Point
123 °C

Chemical Identifiers

SMILES
B1(OCC(CO1)(C)C)C2=CN=CC3=CC=CC=C23
InChIKey
AQEZCUCPPAKCLQ-UHFFFAOYSA-N

Database References

MDL Number
MFCD06659058

FAQ

4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)isoquinoline is a crystalline solid with a molecular weight of approximately 315.34 g/mol. It has poor water solubility but is soluble in organic solvents like acetone and dichloromethane. The compound shows moderate reactivity, particularly towards nucleophilic substitution reactions. It is stable under normal conditions but should be stored away from moisture and heat to prevent decomposition.
4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)isoquinoline is typically synthesized via a boronate ester formation reaction. The process involves the reaction of isoquinoline with 1,3,2-dioxaborine in the presence of a base and a palladium catalyst. High yield and good selectivity are achievable under optimized conditions, making it a valuable synthetic route in organic synthesis.
4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)isoquinoline finds applications in pharmaceuticals, where it serves as a building block for drug synthesis. It is also used in the synthesis of functional polymers for medical devices and sensors. Additionally, it plays a role in semiconductor manufacturing as a precursor for advanced materials.
When handling 4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)isoquinoline, it is essential to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure. In case of spill, handle with care and follow the safety data sheet (SDS) recommendations for disposal. Storage should be in a cool, dry place, away from moisture and heat sources.

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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