tert-Butyl 4-(prop-2-yn-1-yl)piperazine-1-carboxylate(CAS: 199538-99-3)

CAS Number
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Basic Information
Molecular Formula
C12H20N2O2
Molecular Weight
224.3 g/mol
Physical Properties
Boiling Point
292.8°C at 760 mmHg
Chemical Identifiers
SMILES
CC(C)(C)OC(=O)N1CCN(CC1)CC#C
InChIKey
OAXARSVKYJPDPA-UHFFFAOYSA-N
Database References
MDL Number
MFCD04039721
FAQ
t-Butyl 4-(prop-2-yn-1-yl)piperazine-1-carboxylate is a crystalline solid with a molecular weight of approximately 285.36 g/mol. It is moderately soluble in common organic solvents like dichloromethane and ethanol. The compound is known for its reactivity, particularly towards nucleophiles and electrophiles. It shows good stability under neutral conditions but can undergo hydrolysis in acidic or basic media.
t-Butyl 4-(prop-2-yn-1-yl)piperazine-1-carboxylate is typically synthesized through a multi-step process involving the coupling of tert-butyl 4-(hydroxyimino)-piperazine-1-carboxylate with propargyl bromide. The reaction is catalyzed by a base such as potassium carbonate in an aprotic solvent like N,N-dimethylformamide (DMF). The yield and selectivity can be optimized by adjusting reaction conditions and using phase transfer catalysts.
t-Butyl 4-(prop-2-yn-1-yl)piperazine-1-carboxylate is used in the pharmaceutical industry for the synthesis of various drug molecules. It also finds applications in the polymer industry due to its reactive functional groups, which can be used for cross-linking and other polymer modifications. Additionally, it is utilized in the production of sensors and semiconductors for its unique chemical properties.
When handling tert-Butyl 4-(prop-2-yn-1-yl)piperazine-1-carboxylate, it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a fume hood to avoid inhalation of vapors. Spills should be cleaned up using an appropriate absorbent material, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for specific 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
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