4-Benzylpiperidine

Basic Information

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CAS Number

31252-42-3

Molecular Formula

C12H17N

Molecular Weight

175.28 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Physical State

Liquid

Melting Point

6-7 °C

Boiling Point

279°C

Refractive Index

n20/D 1.537(lit.)

SMILES

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C1CNCCC1CC2=CC=CC=C2

InChI

InChI=1S/C12H17N/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12/h1-5,12-13H,6-10H2

InChIKey

ABGXADJDTPFFSZ-UHFFFAOYSA-N

LogP

2.2287

Topological Polar Surface Area

12.03 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

132

Safety Information

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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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

31252-42-3
FT-0617674
B0387
CHEMBL144129
UNII-JDF1T4667S
4-Benzylpiperidine
AB00568
DTXSID3067603
WLN: T6MTJ D1R
4-(phenylmethyl)-piperidin
BB 0253968
AC-6673
4-benzyl piperidine
NS00029048
4-Benzylpiperidine, 99%
4-(Phenylmethyl)piperidine
Q4637101
Z104474316
4-phenylmethylpiperidine
MFCD00006006
EINECS 250-535-0
A5659
Oprea1_832871
Q-103028
STR03314
BDBM50004317
NSC30346
NSC 30346
4-benzyl-piperidin
4-benzyl piperidin
NSC-30346

MDL Number

MFCD00006006

Customs Code

2933399090

FAQ

What regulatory guidelines apply to 4-Benzylpiperidine (CAS: 31252-42-3)?

4-Benzylpiperidine (CAS: 31252-42-3) falls under the regulatory guidelines of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and the European Chemicals Agency (ECHA) under REACH regulations. In the USA, it is classified by the Environmental Protection Agency (EPA) and regulated by the Food and Drug Administration (FDA) for pharmaceutical applications. It is important to ensure compliance with local and national regulations for handling, storage, and disposal.

Are there alternatives to 4-Benzylpiperidine (CAS: 31252-42-3) in synthesis?

Yes, there are several alternatives to 4-Benzylpiperidine (CAS: 31252-42-3) in synthesis, including 4-Methylpiperidine and 4-Phenylpiperidine. These compounds can offer similar functional groups for substitution or can provide different properties depending on the desired application. The choice of alternative often depends on the desired chemical properties and the specific requirements of the synthetic route.

What is the market or research trend for 4-Benzylpiperidine (CAS: 31252-42-3)?

The market for 4-Benzylpiperidine (CAS: 31252-42-3) is primarily driven by its use in pharmaceutical research and development. Recent trends show an increasing interest in developing new drugs for pain management and psychiatric disorders, which are expected to drive demand. Research is also focusing on the synthesis of novel analogs and isomers to explore their potential therapeutic benefits.

How should waste containing 4-Benzylpiperidine (CAS: 31252-42-3) be handled?

Waste containing 4-Benzylpiperidine (CAS: 31252-42-3) should be collected in appropriate containers and stored in a well-ventilated area away from ignition sources. Proper incineration or professional waste disposal services should be utilized to handle this waste. Environmental protection measures should include neutralizing the waste to reduce its toxicity before disposal, and following local and national waste management regulations to ensure safe disposal.