Benzyl 4-methylene-1-piperidinecarboxylate

Basic Information

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CAS Number

138163-12-9

Molecular Formula

C14H17NO2

Molecular Weight

231.3 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

SMILES

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C=C1CCN(CC1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H17NO2/c1-12-7-9-15(10-8-12)14(16)17-11-13-5-3-2-4-6-13/h2-6H,1,7-11H2

InChIKey

FQLKVNIQHUASLU-UHFFFAOYSA-N

LogP

2.975200000000002

Topological Polar Surface Area

29.540000000000003 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

272

Synonyms & References

English

BB 0323034
PB14744
AKOS015969325
1-BENZYLOXYCARBONYL-4-METHYLENEPIPERIDINE
1-Cbz-4-methylene-piperidine
SCHEMBL2454574
FQLKVNIQHUASLU-UHFFFAOYSA-N
4-Methylene-piperidine-1-carboxylic acid benzyl ester
benzyl 4-methylenepiperidine-1-carboxylate
EN300-366564
BENZYL 4-METHYLIDENEPIPERIDINE-1-CARBOXYLATE
DTXSID50573572
AS-39040
138163-12-9
SY097146
A2980
1-Cbz-4-Methylenepiperidine
AM803190
CS-0036611
FT-0660526
MFCD09834622
J-007101
benzyl 4-methylene-1-piperidinecarboxylate
Benzyl4-methylenepiperidine-1-carboxylate
1-PIPERIDINECARBOXYLIC ACID, 4-METHYLENE-, PHENYLMETHYL ESTER
Benzyl 4-methylenepiperidine-1-carboxylate
1-Cbz-4-methylenepiperidine
1-Piperidinecarboxylic acid, 4-methylene-, phenylmethyl ester
benzyl 4-methylidenepiperidine-1-carboxylate
N-benzyloxycarbonyl-4-methylenepiperidine
N-Cbz-4-methylenepiperidine

MDL Number

MFCD09834622

Customs Code

2933399090

FAQ

What are the physical and chemical properties of Benzyl 4-methylene-1-piperidinecarboxylate (CAS: 138163-12-9)?

Benzyl 4-methylene-1-piperidinecarboxylate (CAS: 138163-12-9) is a crystalline solid with a molecular weight of approximately 245.31 g/mol. It is sparingly soluble in water but soluble in organic solvents like ethanol and acetone. Chemically, it is reactive towards basic conditions and can undergo hydrolysis. It is stable under normal storage conditions but should be protected from moisture and strong acids.

How is Benzyl 4-methylene-1-piperidinecarboxylate (CAS: 138163-12-9) typically synthesized?

Benzyl 4-methylene-1-piperidinecarboxylate (CAS: 138163-12-9) is typically synthesized through the condensation of benzyl chloroformate with 4-methyl-1-piperidinemethanol. The reaction is usually performed in the presence of a base like triethylamine to promote the formation of the desired ester product. The yield can be improved by using an appropriate catalyst and optimizing reaction conditions.

What industries use Benzyl 4-methylene-1-piperidinecarboxylate (CAS: 138163-12-9)?

Benzyl 4-methylene-1-piperidinecarboxylate (CAS: 138163-12-9) is used in the pharmaceutical industry for the synthesis of certain drugs, as a precursor in the polymer industry for developing functional polymers, and in the sensor industry for creating sensitive chemical sensors. It also has potential applications in organic electronics, particularly in the field of organic semiconductors.

What precautions should be taken when handling Benzyl 4-methylene-1-piperidinecarboxylate (CAS: 138163-12-9)?

When handling Benzyl 4-methylene-1-piperidinecarboxylate (CAS: 138163-12-9), it is important to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and lab coat. The substance should be handled in a fume hood to minimize exposure to vapors. Spills should be cleaned up with caution, using appropriate absorbent materials, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for detailed safety information and emergency procedures.