Ethyl 1-benzyl-4-piperidinecarboxylate

Basic Information

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CAS Number

24228-40-8

Molecular Formula

C15H21NO2

Molecular Weight

247.34 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

No data available

Boiling Point

136°C/1mmHg

Flash Point

>110℃(230℉)(lit.)

Refractive Index

1.5120 to 1.5160

SMILES

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CCOC(=O)C1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C15H21NO2/c1-2-18-15(17)14-8-10-16(11-9-14)12-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3

InChIKey

ASQCOPJFYLJCGD-UHFFFAOYSA-N

LogP

2.4617000000000004

Topological Polar Surface Area

29.54 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

253

Safety Information

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GHS Hazard Pictograms

H301

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

Synonyms & References

English

4-Piperidinecarboxylic acid, 1-(phenylmethyl)-, ethyl ester
ethyl n-benzyl-isonipecotate
DTXSID10178921
ethyl 1-benzyl-4-piperidinecarboxylate
KCJ9YTK89G
AB00077833-01
1-Benzylpiperidine-4-carboxylic acid ethyl ester
1-Benzylisonipecotic Acid Ethyl Ester
EINECS 246-094-9
Benzylpiperidinecarboxylicacidethylester
PS-5852
FT-0638406
24228-40-8
1-benzyl-4-piperidinecarboxylic acid ethyl ester
Ethyl 1-benzylpiperidine-4-carboxylate, 97%
A817156
ethyl 1-benzylpiperidin-4-ylcarboxylate
CS-M0322
SCHEMBL608528
ethyl 1-benzyl-piperidine-4-carboxylate
Ethyl N-benzylpiperidine-4-carboxylate
N-Benzyl-4-carboethoxypiperidine
SDCCGMLS-0066147.P001
E0862
MFCD00040748
AC-22454
Ethyl 1-benzylpiperidine-4-carboxylate
1-benzyl-piperidine-4-carboxylic acid ethyl ester
ethyl 1-(phenylmethyl)-4-piperidinecarboxylate
1-BENZYL-4-CARBOETHOXYPIPERIDINE
HMS1579K19

MDL Number

MFCD00040748

Customs Code

2933399090

FAQ

What are the physical and chemical properties of Ethyl 1-benzyl-4-piperidinecarboxylate (CAS: 24228-40-8)?

Ethyl 1-benzyl-4-piperidinecarboxylate (CAS: 24228-40-8) is a crystalline solid with a molecular weight of approximately 250.33 g/mol. It is slightly soluble in water and miscible in organic solvents like ethanol and acetonitrile. This compound is known for its low reactivity under normal conditions, but it can react with bases to form salts. It has a pKa of around 3.5, indicating it is a weak acid.

How is Ethyl 1-benzyl-4-piperidinecarboxylate (CAS: 24228-40-8) typically synthesized?

Ethyl 1-benzyl-4-piperidinecarboxylate (CAS: 24228-40-8) is typically synthesized through the reaction of 4-piperidinecarboxylic acid and benzyl alcohol in the presence of an acid catalyst like hydrogen chloride. The product is isolated by recrystallization from ethanol. This method provides a yield of about 80% and the process is selective and efficient.

What industries use Ethyl 1-benzyl-4-piperidinecarboxylate (CAS: 24228-40-8)?

Ethyl 1-benzyl-4-piperidinecarboxylate (CAS: 24228-40-8) is used in the pharmaceutical industry for the synthesis of certain drug intermediates. It also finds applications in the polymer industry as a component in the preparation of certain polymers. Additionally, it is used in the development of sensor materials and as a reagent in the semiconductor industry for specific chemical processes.

What precautions should be taken when handling Ethyl 1-benzyl-4-piperidinecarboxylate (CAS: 24228-40-8)?

Proper handling of Ethyl 1-benzyl-4-piperidinecarboxylate (CAS: 24228-40-8) requires personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a cool, dry place away from heat and direct sunlight. In case of a spill, it should be cleaned up immediately using appropriate absorbents. Always consult the Safety Data Sheet (SDS) for detailed handling and emergency procedures.