1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid | CAS No. 896046-65-4

1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid

Basic Information

CAS Number

896046-65-4

Molecular Formula

C13H16FNO2

Molecular Weight

237.27 g/mol

AD

Basic Physical Properties

Density

1.234

C1CC(CN(C1)CC2=CC=CC=C2F)C(=O)O

InChI

InChI=1S/C13H16FNO2/c14-12-6-2-1-4-10(12)8-15-7-3-5-11(9-15)13(16)17/h1-2,4,6,11H,3,5,7-9H2,(H,16,17)

InChIKey

KOXCBDNTCRUQDS-UHFFFAOYSA-N

LogP

2.1223

Topological Polar Surface Area

40.540000000000006 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

272

Synonyms & References

English

  • 1-(2-Fluoro-benzyl)-piperidine-3-carboxylic acid
  • 1-(2-fluorobenzyl)piperidine-3-carboxylic acid
  • F1908-2083
  • 1-(2-fluorobenzyl)piperidine-3-carboxylicacid
  • FT-0766718
  • 1-[(2-Fluorophenyl)methyl]-3-piperidinecarboxylic acid
  • 896046-65-4
  • AKOS009484356
  • DTXSID90397991
  • 1-[(2-fluorophenyl)methyl]piperidine-3-carboxylic Acid
  • 1-(2-Fluorobenzyl)piperidine-3-carboxylic acid
  • 1-(2-FLUORO-BENZYL)-PIPERIDINE-3-CARBOXYLIC ACID
  • 1-[(2-fluorophenyl)methyl]-3-Piperidinecarboxylic acid
  • 1-[(2-fluorophenyl)methyl]piperidine-3-carboxylic acid

MDL Number

MFCD05170986

FAQ

What are the physical and chemical properties of 1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid (CAS: 896046-65-4)?

1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid is a crystalline solid with a molecular weight of approximately 272.22 g/mol. It is slightly soluble in water and more soluble in organic solvents like methanol and ethanol. The compound exhibits good stability under normal conditions but shows reactivity towards bases and reducing agents.

How is 1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid (CAS: 896046-65-4) typically synthesized?

1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid is typically synthesized via the coupling of 2-fluorobenzyl chloride with 3-piperidinemethanol. The reaction is catalyzed by a suitable base like triethylamine and proceeds with good yield. The purity can be ensured by recrystallization from an appropriate solvent.

What industries use 1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid (CAS: 896046-65-4)?

1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid is used in the pharmaceutical industry for the synthesis of various drugs due to its unique chemical structure. It also finds applications in the polymer industry for the development of advanced materials. Additionally, it is utilized in the semiconductor and sensor industries for its specific functional properties.

What precautions should be taken when handling 1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid (CAS: 896046-65-4)?

When handling 1-(2-Fluorobenzyl)-3-piperidinecarboxylic acid, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The substance should be used in a well-ventilated area or a fume hood to minimize exposure. In case of a spill, immediate containment and clean-up should be performed following the safety data sheet (SDS) guidelines. Proper storage conditions should be maintained to ensure the compound's stability and safety.

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