1-Benzyl-4-piperidinone

Basic Information

View in Editor

CAS Number

3612-20-2

Molecular Formula

C12H15NO

Molecular Weight

189.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

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

158°C/11mmHg

Water Solubility

12 g/L (20 ºC)

Solubility

12g/l

Refractive Index

n20/D 1.541(lit.)

SMILES

View in Editor

O=C1CCN(Cc2ccccc2)CC1

InChI

InChI=1S/C12H15NO/c14-12-6-8-13(9-7-12)10-11-4-2-1-3-5-11/h1-5H,6-10H2

InChIKey

SJZKULRDWHPHGG-UHFFFAOYSA-N

LogP

1.8515000000000001

Topological Polar Surface Area

20.310000000000002 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

187

Safety Information

View Safety Information

GHS Hazard Pictograms

H315

H319

H335

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

Sensitiveness

sensitive to heat and air

Synonyms & References

English

1-Benzylpiperidin-4-one
NSC 77933
1-BENZYL-4-PIPERIDINONE FOR SYNTHESIS
[(4-Oxopiperidin-1-yl)methyl]benzene, 1-Benzyl-4-oxopiperidine
N- benzylpiperidineketone
4-Piperidone, 1-benzyl-
1-Benzyl-4-piperidone
N-Benzyl-4-piperidone
1-Benzyl-4-Pipridine
1-Benzylpiperidone
1-Phenylmethyl-piperidin-4-one
Benzyl piperidone
BENZYL-4-PIPERIDONE
BENZYLPIPERIDONE-4
N-Benzyl-4-piperidon
N-Benzylpiperidinone
N-BENZYLPIPERIDONE
1-(Phenylmethyl)-4-piperidinone
4-Piperidinone, 1-(phenylmethyl)-
1-Benzyl-4-oxopiperidine
1-benzyl-piperidin-4-one
1-Benzyl-4-piperidinone
N-Benzylpiperidin-4-one
N-Benzyl-4-piperidinone
4-N-Benzylpiperidone
MLS002694053
SJZKULRDWHPHGG-UHFFFAOYSA-N
399249PH5B
N-Benzyl-4-piperidine
NSC77933
EIN

MDL Number

MFCD00006192

Customs Code

29333999

FAQ

What is 1-Benzyl-4-piperidinone (CAS: 3612-20-2)?

1-Benzyl-4-piperidinone is an organic compound with the chemical formula C11H15NO. It features a benzyl group attached to a piperidine ring with a ketone functional group at position 4. This compound is a solid at room temperature, slightly soluble in water, and commonly used as an intermediate in chemical synthesis. Its structure makes it valuable in pharmaceutical and research applications due to its reactivity and ability to form complex derivatives.

What are the main uses of 1-Benzyl-4-piperidinone (CAS: 3612-20-2)?

1-Benzyl-4-piperidinone is primarily used in pharmaceutical research as a key intermediate for synthesizing bioactive molecules and drug candidates. It also serves in organic chemistry for creating derivatives with diverse applications, including agrochemicals and materials science. Its unique structure enables it to participate in various reactions, making it a versatile compound in academic and industrial settings.

Is 1-Benzyl-4-piperidinone (CAS: 3612-20-2) safe?

1-Benzyl-4-piperidinone is considered moderately toxic and requires careful handling. Safety measures include wearing gloves, goggles, and lab coats to avoid skin or eye contact, and working in a well-ventilated area. It is not classified as carcinogenic, but proper disposal and adherence to OSHA guidelines are essential to minimize health and environmental risks.

How should 1-Benzyl-4-piperidinone (CAS: 3612-20-2) be stored?

1-Benzyl-4-piperidinone should be stored in a cool, dry place (2-8°C), away from light and moisture. Keep it in a sealed, airtight container to maintain stability and prevent degradation. Avoid exposure to strong oxidizing agents and store in a well-ventilated area to ensure safety and prolong shelf life.