1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine | CAS No. 1323919-64-7

1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine

Basic Information

CAS Number

1323919-64-7

Molecular Formula

C15H26BN3O2

Molecular Weight

291.2 g/mol

AD

Basic Physical Properties

Boiling Point

409.1±35.0℃ at 760 mmHg

CN1CCC(CC1)n1ncc(c1)B1OC(C(O1)(C)C)(C)C

InChI

InChI=1S/C15H26BN3O2/c1-14(2)15(3,4)21-16(20-14)12-10-17-19(11-12)13-6-8-18(5)9-7-13/h10-11,13H,6-9H2,1-5H3

InChIKey

PRLTVODJPCFDHW-UHFFFAOYSA-N

LogP

1.4489999999999994

Topological Polar Surface Area

39.52 Ų

Hydrogen Bond Donor/Acceptor

0 / 5

Synonyms & References

English

  • 1-Methyl-4-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyrazol-1-yl]piperidine
  • 1-methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)piperidine
  • 1-methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)-1H-pyrazol-1-yl]-piperidine
  • 1-methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)
  • 1-methyl-4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine

MDL Number

MFCD21337767

FAQ

What are the physical and chemical properties of 1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine (CAS: 1323919-64-7)?

1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine is a white crystalline solid with a molecular weight of approximately 438.47 g/mol. It is slightly soluble in water and more soluble in organic solvents like DMSO. The compound is reactive towards nucleophiles and readily undergoes substitution reactions.

How is 1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine (CAS: 1323919-64-7) typically synthesized?

1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine is commonly synthesized via a multi-step process involving the coupling of a pyrazole derivative with 1-methylpiperidine in the presence of a borate ester and a palladium catalyst. The reaction is typically carried out under standard conditions of temperature and pressure with high selectivity and yield.

What industries use 1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine (CAS: 1323919-64-7)?

1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine is primarily used in the pharmaceutical industry for the synthesis of various drug candidates. It is also applied in the chemical and materials industry for the development of novel materials with specific properties.

What precautions should be taken when handling 1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine (CAS: 1323919-64-7)?

When handling 1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and lab coats. The compound should be handled in a well-ventilated area or a fume hood. In case of a spill, immediately clean up using the appropriate spill kit and follow safety protocols. Refer to the Safety Data Sheet (SDS) for detailed handling instructions.

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