2-(1-Piperazinyl)aniline

Basic Information

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CAS Number

13339-02-1

Molecular Formula

C10H15N3

Molecular Weight

177.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

110 °C

SMILES

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C1CN(CCN1)C2=CC=CC=C2N

InChI

InChI=1S/C10H15N3/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8,11H2

InChIKey

TZWRXFPFRACRLO-UHFFFAOYSA-N

LogP

0.6783999999999999

Topological Polar Surface Area

41.29 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

154

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Oprea1_502972
SCHEMBL532010
MFCD03444413
2-(1-Piperazino)aniline
Q27461764
13339-02-1
A888119
DTXSID20330614
JRB
EN300-7365792
2-Piperazin-1-Yl-Aniline
2-Piperazin-1-yl-phenylamine
2-(piperazin-1-yl)aniline
TS-02469
AKOS003587591
2-(piperazin-1-yl)benzenamine
CHEBI:195050
2-PIPERAZIN-1-YLANILINE; Benzenamine, 2-(1-piperazinyl)- (9CI); 2-Piperazin-1-ylaniline 95%; 2-(1-Piperazino)aniline, 95%
2-piperazin-1-ylaniline
FT-0636872
2-(Piperazin-1-yl)benzenamine
2-PIPERAZIN-1-YLANILINE
Benzenamine, 2-(1-piperazinyl)- (9CI)
2-(1-Piperazinyl)aniline
1-(2-AMinophenyl)piperazine
2-(1-Piperazino)aniline 3HCl
2-Piperazin-1-ylaniline 95%
2-(1-Piperazino)aniline, 95%
2-(Piperazin-1-yl)aniline95%
2-(1-Piperazinyl)aniline, 95%

MDL Number

MFCD03444413

Customs Code

2933599090

FAQ

What regulatory guidelines apply to 2-(1-Piperazinyl)aniline (CAS: 13339-02-1)?

2-(1-Piperazinyl)aniline (CAS: 13339-02-1) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), which includes hazards such as skin and eye irritation. In the European Union, this compound falls under the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulation, requiring detailed safety data sheets. The FDA and EPA may also have specific requirements for its handling and sale in the US, including proper labeling and storage instructions to prevent exposure and environmental contamination.

Are there alternatives to 2-(1-Piperazinyl)aniline (CAS: 13339-02-1) in synthesis?

Alternatives to 2-(1-Piperazinyl)aniline (CAS: 13339-02-1) in synthesis include other aromatic amines or piperazine derivatives, depending on the desired end-product properties. Common substitutes include 2-aminophenol and 4-aminobenzenesulfonic acid, which can serve as precursors in various chemical reactions. The choice of alternative often depends on the specific reaction conditions and desired product characteristics.

What is the market or research trend for 2-(1-Piperazinyl)aniline (CAS: 13339-02-1)?

The market for 2-(1-Piperazinyl)aniline (CAS: 13339-02-1) is driven by its use in pharmaceuticals, agrochemicals, and dyes. Research trends are focused on its potential as a precursor in the synthesis of active pharmaceutical ingredients (APIs) and its application in functional materials. However, due to its regulated status, there is an ongoing need for safer, more sustainable alternatives in both academic and industrial settings.

How should waste containing 2-(1-Piperazinyl)aniline (CAS: 13339-02-1) be handled?

Waste containing 2-(1-Piperazinyl)aniline (CAS: 13339-02-1) should be handled according to local and international regulations. It is recommended to collect the waste in appropriate containers, ensuring it is labeled with proper hazardous waste identification. Disposal should be carried out through professional waste disposal services, and incineration may be used if other methods are not feasible. Environmental protection measures, such as neutralizing any acidic or basic residues, should be implemented to prevent contamination of soil and water sources.