1-Boc-4-cyanopiperidine

Basic Information

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CAS Number

91419-52-2

Molecular Formula

C11H18N2O2

Molecular Weight

199.29 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 Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

60.0 to 64.0 deg-C

Density

1.07

Flash Point

150.5℃

Refractive Index

1.488

SMILES

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CC(C)(C)OC(=O)N1CCC(CC1)C#N

InChI

InChI=1S/C11H18N2O2/c1-11(2,3)15-10(14)13-6-4-9(8-12)5-7-13/h9H,4-7H2,1-3H3

InChIKey

UQADQTBQNVARAP-UHFFFAOYSA-N

LogP

2.6534000000000013

Topological Polar Surface Area

29.54 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

277

Safety Information

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GHS Hazard Pictograms

H302

H319

H400

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H400 Very toxic to aquatic life
Hazardous to the aquatic environment, acute hazard

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

1-Boc-4-Cyanopiperidine
N-BOC-4-CYANO-PIPERIDINE
TERT-BUTYL 4-CYANOPIPERIDINE-1-CARBOXYLATE
1-N-BOC-4-CYANO-PIPERIDINE
1-N-BOC-PIPERIDINE-4-CARBONITRILE
4-CYANO-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
4-CYANOPIPERIDINE, N-BOC PROTECTED
1-Piperidinecarboxylic acid, 4-cyano-, 1,1-dimethylethyl ester
1-tert-Butoxycarbonyl-4-cyanopiperidine
N-Boc-piperidine-4-carbonitrile
1-Boc-4-cyapiperidine
1-N-Boc-4-cyanopiperidine
MDL number MFCD,N-Boc-piperidine-4-carbonitrile
N-BOC-4-cyanopiperidine
tert-Butyl 4-(cyanomethyl)piperidine-1-carboxylate
1,1-Dimethylethyl 4-cyano-1-piperidinecarboxylate
4-Cyano-1-piperidinecarboxylic acid 1,1-dimethylethyl ester
1-Boc-4-piperidinecarbonitrile
1-tert-Butoxycarbonyl-4-piperidinecarbonitrile
tert-Butyl 4-Cyano-1-piperidinecarboxylate
4-Cyano-1-piperidinecarboxylic Acid tert-Butyl Ester
4-CYANO-1-PIPERIDINE
1-(tert-Butoxycarbonyl)-4-cyanopiperidine
1-(tert-Butoxycarbonyl)piperidine-4-carbonitrile
1-Boc-4-cyanopiperidine
4-Cyanopiperidine-1-carboxylic acid tert-butyl ester
N-Boc-4-cyanopiperidine
N-tert-Butoxycarbonyl-4-cyanopiperidine
N-tert-Butoxycarbonyl-4-piperidinecarbonitrile
tert-Butyl 4-cyanopiperidine-1-carboxylate
tert-butyl 4-cyanopiperidine-1-carboxylate

MDL Number

MFCD01861223

Customs Code

2933399090

FAQ

What is 1-Boc-4-cyanopiperidine (CAS: 91419-52-2)?

1-Boc-4-cyanopiperidine (CAS: 91419-52-2) is a piperidine derivative with a cyano group at the 4-position and a tert-butoxycarbonyl (Boc) protecting group at the 1-position. It is a white to pale yellow solid with a molecular formula of C10H16N2O2 and is commonly used in organic synthesis as an intermediate. The compound exhibits moderate solubility in polar solvents and is stable under normal conditions.

What are the main uses of 1-Boc-4-cyanopiperidine (CAS: 91419-52-2)?

1-Boc-4-cyanopiper啶 (91419-52-2) is widely used in pharmaceutical research for the synthesis of various bioactive compounds, including drugs and agrochemicals. It also finds applications in the production of organic chemicals and as a building block in the development of complex molecules. Its utility in protecting groups and functional group transformations makes it a valuable reagent in chemical research.

Is 1-Boc-4-cyanopiperidine (CAS: 91419-52-2) safe?

1-Boc-4-cyanopiperidine (CAS: 91419-52-2) is generally considered safe when handled properly, but it should be treated with caution due to its potential irritancy. It is recommended to use appropriate personal protective equipment (PPE) such as gloves and goggles. Safety data sheets (SDS) should be consulted for detailed information on handling and exposure limits.

How should 1-Boc-4-cyanopiperidine (CAS: 91419-52-2) be stored?

1-Boc-4-cyanopiperidine (CAS: 91419-52-2) should be stored in a cool, dry, and well-ventilated area, away from direct light. It is best kept in a sealed container at a temperature below 25°C. Avoid exposure to moisture and incompatible substances to ensure stability and prolong shelf life.