tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate | CAS No. 890709-17-8

tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate

Basic Information

CAS Number

890709-17-8

Molecular Formula

C18H23N3O2

Molecular Weight

313.4 g/mol

AD

Basic Physical Properties

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H23N3O2/c1-18(2,3)23-17(22)21-12-10-20(11-13-21)16-9-8-14-6-4-5-7-15(14)19-16/h4-9H,10-13H2,1-3H3

InChIKey

MOGQKMUFSORICV-UHFFFAOYSA-N

LogP

3.291900000000002

Topological Polar Surface Area

45.67 Ų

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

413

Synonyms & References

English

  • tert-butyl 4-quinolin-2-ylpiperazine-1-carboxylate
  • tert-Butyl 4-(Quinolin-2-yl)piperazine-1-carboxylate
  • Tert-butyl 4-quinolin-2-ylpiperazine-1-carboxylate
  • AKOS027338638
  • MFCD24389548
  • MOGQKMUFSORICV-UHFFFAOYSA-N
  • tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate
  • DS-12217
  • 4-Quinolin-2-yl-piperazine-1-carboxylic acid tert.-butyl ester
  • SCHEMBL4055019
  • 890709-17-8
  • tert-Butyl4-(quinolin-2-yl)piperazine-1-carboxylate

MDL Number

MFCD24389548

FAQ

What are the physical and chemical properties of tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate (CAS: 890709-17-8)?

The physical properties of tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate include a white crystalline form and a molecular weight of approximately 404.43 g/mol. It has a low solubility in water but is soluble in organic solvents like methanol and dichloromethane. Chemically, it exhibits moderate reactivity under basic conditions, making it suitable for various synthetic transformations.

How is tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate (CAS: 890709-17-8) typically synthesized?

tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate is commonly synthesized through a multistep process involving quinoline coupling with piperazine. The synthesis typically employs catalysts such as tetrakis(triphenylphosphine)palladium(0) and proceeds with a high yield under mild conditions. The product is purified by recrystallization or column chromatography.

What industries use tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate (CAS: 890709-17-8)?

tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate is primarily used in the pharmaceutical industry for the development of new medicinal compounds. It also finds applications in the sensor industry due to its potential as a ligand. Additionally, it may be involved in the synthesis of materials for semiconductor technologies.

What precautions should be taken when handling tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate (CAS: 890709-17-8)?

When handling tert-Butyl 4-(quinolin-2-yl)piperazine-1-carboxylate, it is essential to use appropriate personal protective equipment (PPE) including gloves and safety goggles. Store the compound in a cool, dry place away from direct sunlight and ensure proper ventilation. In case of a spill, use appropriate cleanup methods and follow the safety data sheet (SDS) for detailed instructions.

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