1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate

Basic Information

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CAS Number

310454-53-6

Molecular Formula

C16H21NO4

Molecular Weight

291.35 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

Boiling Point

537.4℃ at 760 mmHg

Flash Point

259.3°C

Refractive Index

1.53

SMILES

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CCOC(=O)C1CCCN(C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H21NO4/c1-2-20-15(18)14-9-6-10-17(11-14)16(19)21-12-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12H2,1H3

InChIKey

NJRONXOELMBCSE-UHFFFAOYSA-N

LogP

2.598300000000001

Topological Polar Surface Area

55.84 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

352

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

SCHEMBL1468838
SY239009
MFCD06657752
Ethyl-N-CBZ-piperidine-3-carboxylate
DS-1891
1-Benzyl 3-ethyl piperidine-1 pound not3-dicarboxylate
Ethyl (S)-1-Cbz-piperidine-3-carboxylate
SY025746
Piperidine-1,3-dicarboxylic acid 1-benzyl ester 3-ethyl ester
1-(benzyloxycarbonyl)piperidine-3-carboxylic acid ethyl ester
310454-53-6
MFCD07374392
FT-0652191
NJRONXOELMBCSE-UHFFFAOYSA-N
3-Ethyl 1-(phenylmethyl) 1,3-piperidinedicarboxylate
1-Cbz-piperidine-3-carboxylic acid ethyl ester
AB39344
Ethyl N-Cbz-piperidine-3-carboxylate
N-Cbz-nipecotic acid ethyl ester
BENZYL ETHYL PIPERIDINE-1,3-DICARBOXYLATE
1-Benzyl 3-ethyl piperidine-1,3-dicarboxylate
A820706
1-O-benzyl 3-O-ethyl piperidine-1,3-dicarboxylate
Cbz-Piperidine-3-carboxylic acid ethyl ester
DTXSID30592327
AB39346
FT-0771387
AKOS008932800
FT-0657958
BENZYL ETHYL PIPERIDINE-1,3-DICARBOXYLATEa
CS-W003300

MDL Number

MFCD06657752

FAQ

What is 1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate (CAS: 310454-53-6)?

1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate (CAS: 310454-53-6) is a chemical compound with the molecular formula C14H18N2O4. It is a derivative of piperidine, featuring a benzyl group and an ethyl group attached to a piperidine ring with carboxylic acid functionalities. This compound is used in the pharmaceutical industry and research due to its structural characteristics.

What are the main uses of 1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate (CAS: 310454-53-6)?

1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate (CAS: 310454-53-6) is primarily used as a research tool and in pharmaceuticals for developing new drugs. It serves as a potential intermediate in organic synthesis and as a scaffold for drug design due to its unique chemical structure.

Is 1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate (CAS: 310454-53-6) safe?

1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate (CAS: 310454-53-6) is generally safe when handled with appropriate precautions. It is important to follow standard safety guidelines, including the use of personal protective equipment (PPE) such as gloves and safety goggles. Storage should be in a cool, dry place away from direct sunlight and heat sources.

How should 1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate (CAS: 310454-53-6) be stored?

1-Benzyl 3-ethyl 1,3-piperidinedicarboxylate (CAS: 310454-53-6) should be stored in a tightly sealed container in a cool, dry place, away from direct sunlight and heat sources. The temperature should be maintained below 25°C (77°F) to prevent degradation. Ensure proper ventilation during storage to avoid the accumulation of flammable vapors.