1-(2-Chloropropyl)piperidine

Basic Information

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CAS Number

698-92-0

Molecular Formula

C8H16ClN

Molecular Weight

161.68 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

388-389 ºC

Boiling Point

80-81 ºC (13 Torr)

Density

0.989±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

77.6±22.6 ºC,

SMILES

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CC(CN1CCCCC1)Cl

InChI

InChI=1S/C8H16ClN/c1-8(9)7-10-5-3-2-4-6-10/h8H,2-7H2,1H3

InChIKey

KFWCHHIRLGAWOS-UHFFFAOYSA-N

LogP

2.0996

Topological Polar Surface Area

3.24 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

89.3

Synonyms & References

English

AKOS016007048
SCHEMBL7260782
MFCD19105113
AS-49947
CS-0154041
N-(2-Chloropropyl)piperidine
SB42946
DTXSID00990058
Piperidine, 1-(2-chloropropyl)-
NS00041971
EINECS 211-823-1
O10264
698-92-0
KFWCHHIRLGAWOS-UHFFFAOYSA-N
1-(2-Chloropropyl)piperidine
Piperidine,1-(2-chloropropyl)-
(+-)-1-<2-Chlor-propyl>-piperidin
1-(2-chloro-propyl)-piperidine
Piperidine,1-(2-chloropropyl)
0821AC
FCH1053197
AX8238216

MDL Number

MFCD19105113

FAQ

What regulatory guidelines apply to 1-(2-Chloropropyl)piperidine (CAS: 698-92-0)?

1-(2-Chloropropyl)piperidine (CAS: 698-92-0) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), which includes classification as a skin and eye irritant. It is also subject to the European Chemicals Agency’s (ECHA) REACH regulations in the European Union, requiring registration for quantities above 1 tonne per year. Additionally, it is regulated by the Food and Drug Administration (FDA) for pharmaceutical applications and by the Environmental Protection Agency (EPA) for environmental protection purposes.

Are there alternatives to 1-(2-Chloropropyl)piperidine (CAS: 698-92-0) in synthesis?

There are several alternatives available for synthesizing similar functionalities, such as 1-(2-Hydroxypropyl)piperidine, which can serve as a non-chlorinated analog. Other alternatives include the use of isomers or substituting the chlorine with other functional groups like bromine, or utilizing different piperidine derivatives depending on the specific application.

What is the market or research trend for 1-(2-Chloropropyl)piperidine (CAS: 698-92-0)?

The market for 1-(2-Chloropropyl)piperidine (CAS: 698-92-0) is primarily driven by its use in pharmaceuticals and as an intermediate in organic synthesis. Research trends are focusing on developing safer and more environmentally friendly alternatives, and studying its potential in drug development, particularly in analgesics and antipsychotics. There is also an increasing interest in exploring its use in agrochemicals and as a precursor for other complex molecules.

How should waste containing 1-(2-Chloropropyl)piperidine (CAS: 698-92-0) be handled?

Waste containing 1-(2-Chloropropyl)piperidine (CAS: 698-92-0) should be collected in suitable containers labeled with appropriate hazard warnings. The waste should be neutralized, if necessary, to avoid hazardous emissions. It should then be disposed of according to local regulations, which often include professional incineration or chemical treatment to ensure environmental safety. Proper waste management is crucial to prevent environmental contamination and comply with regulatory requirements.