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1-{[2-(4-Chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl}piperazine(CAS: 1228780-72-0)

1-{[2-(4-Chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl}piperazine
CAS Number

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Basic Information

Molecular Formula
C19H27ClN2
Molecular Weight
318.89 g/mol

Physical Properties

Boiling Point
421.2±45.0°C at 760 mmHg

Chemical Identifiers

SMILES
CC1(C)CCC(=C(C1)c2ccc(Cl)cc2)CN3CCNCC3
InChIKey
YCNNHDUZLQPKJY-UHFFFAOYSA-N

Database References

MDL Number
MFCD28129720

FAQ

1-{[2-(4-Chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl}piperazine has a molecular weight of approximately 381.1 g/mol and is crystalline at room temperature. It is poorly water-soluble but soluble in common organic solvents like DMSO and DMF. Chemically, it is stable under normal conditions but may react with strong acids or bases. It does not have significant reactivity with common laboratory chemicals.
This compound is typically synthesized via a multi-step process involving the reaction of 4-chlorophenyl isocyanate with 4,4-dimethyl-1-cyclohexene, followed by the formation of a piperazine ring via alkylation. The reaction conditions and catalysts are carefully chosen to ensure high selectivity and yield, although specific details can vary based on the exact synthetic route chosen.
1-{[2-(4-Chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl}piperazine finds applications in the pharmaceutical industry for its potential as a chemical intermediate or drug candidate. It may also be used in the polymer industry for specialized applications and in the development of sensors and semiconductors due to its structural complexity and functional groups.
Handling 1-{[2-(4-Chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl}piperazine requires appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be performed in a well-ventilated area or a fume hood due to its potential to irritate the respiratory system. In case of a spill, it should be handled according to the Safety Data Sheet (SDS) guidelines, which may include the use of absorbent materials and proper disposal methods.

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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