4-(1-Piperazinyl)-1H-indole

Basic Information

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CAS Number

84807-09-0

Molecular Formula

C12H15N3

Molecular Weight

201.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

204-206°C

Boiling Point

421.5°C at 760 mmHg

Density

1.182

Flash Point

208.7 °C

Refractive Index

1.65

SMILES

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C1CN(CCN1)c2cccc3[nH]ccc23

InChI

InChI=1S/C12H15N3/c1-2-11-10(4-5-14-11)12(3-1)15-8-6-13-7-9-15/h1-5,13-14H,6-9H2

InChIKey

YZKSXUIOKWQABW-UHFFFAOYSA-N

LogP

1.5774999999999997

Topological Polar Surface Area

31.06 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

213

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Synonyms & References

English

4-(1-Piperazinyl)-1H-indole
4-(1-Piperazinyl)-1H-indole Dihydrochloride
4-(Piperazin-1-yl)-1H-indole
4-piperazin-1-yl-1H-indole
4-Piperazino-1H-indole
4-(Piperazino)indole
1H-Indole, 4-(1-piperazinyl)-
YZKSXUIOKWQABW-UHFFFAOYSA-N
1-(4-indolyl)piperazine
1H-Indole-4-(1-piperazinyl)dihydrochloride
4-piperazinoindole
4-piperazino-indole
PubChem22668
1H-indol-4-ylpiperazine
4-(1-piperazinyl)indole
1-(indol-4yl)piperazine
1-(indol-4yl)-piperazine
1-(4-indolyl)-piperazine
1-(indol-4-yl)piperazine
Oprea1
4-(piperazin-1-yl)-1H-indole

MDL Number

MFCD00831776

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 4-(1-Piperazinyl)-1H-indole (CAS: 84807-09-0)?

4-(1-Piperazinyl)-1H-indole is a crystalline solid with a molecular weight of approximately 264.34 g/mol. It has a limited water solubility and is highly soluble in organic solvents like DMSO and DMF. The compound is relatively stable under normal conditions but can be susceptible to hydrolysis under basic conditions. It shows reactive behavior towards strong acids and bases.

How is 4-(1-Piperazinyl)-1H-indole (CAS: 84807-09-0) typically synthesized?

4-(1-Piperazinyl)-1H-indole is synthesized via the indole synthesis route, typically starting from indole and reacting it with 1-piperazinecarboxylic acid. The reaction is catalyzed by a Lewis acid such as aluminum chloride, and the product is obtained with a yield of around 70-80%. The reaction is selective and proceeds under mild conditions.

What industries use 4-(1-Piperazinyl)-1H-indole (CAS: 84807-09-0)?

4-(1-Piperazinyl)-1H-indole is primarily used in the pharmaceutical industry for the synthesis of various medicinal compounds. It is also utilized in the development of sensors and as a precursor in the production of semiconductors. Additionally, it finds applications in the polymer industry for enhancing the properties of certain polymer materials.

What precautions should be taken when handling 4-(1-Piperazinyl)-1H-indole (CAS: 84807-09-0)?

When handling 4-(1-Piperazinyl)-1H-indole, appropriate personal protective equipment (PPE) should be worn, including gloves and eye protection. The compound should be handled in a well-ventilated area or a fume hood. Proper spill containment and disposal procedures should be followed according to the Material Safety Data Sheet (SDS). In case of contact, flush the affected area with water and seek medical attention. Store the compound in a cool, dry place, away from heat sources and oxidizers.