1-(1H-Indol-6-yl)ethanone

Basic Information

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CAS Number

81223-73-6

Molecular Formula

C10H9NO

Molecular Weight

159.19 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

Basic Physical Properties

Melting Point

122-123 ºC (ethyl acetate )

Density

1.193±0.06 g/cm3 (20 ºC 760 Torr),

SMILES

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CC(=O)c1ccc2c(c1)[nH]cc2

InChI

InChI=1S/C10H9NO/c1-7(12)9-3-2-8-4-5-11-10(8)6-9/h2-6,11H,1H3

InChIKey

MVLKLQSCKJWWLP-UHFFFAOYSA-N

LogP

2.3705

Topological Polar Surface Area

32.86 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Synonyms & References

English

1-(1H-Indol-6-yl)ethanone
6-Acetylindole
Ethanone, 1-(1H-indol-6-yl)- (9CI)

MDL Number

MFCD09035921

FAQ

What regulatory guidelines apply to 1-(1H-Indol-6-yl)ethanone (CAS: 81223-73-6)?

1-(1H-Indol-6-yl)ethanone (CAS: 81223-73-6) falls under the scope of GHS classification, which includes health and environmental hazards. It is also subject to REACH regulations in the European Union, requiring registration and reporting of substances above a certain tonnage. In the USA, the FDA and EPA have specific guidelines for the handling and transportation of this compound. Proper labeling and documentation are essential to comply with these regulations.

Are there alternatives to 1-(1H-Indol-6-yl)ethanone (CAS: 81223-73-6) in synthesis?

Yes, there are alternative reagents and synthetic routes that can be used instead of 1-(1H-Indol-6-yl)ethanone (CAS: 81223-73-6). For example, 1-(1H-indol-5-yl)ethanone and other indole derivatives can be used as alternative starting materials. Additionally, green chemistry principles can guide the selection of more sustainable and environmentally friendly reagents and catalysts.

What is the market or research trend for 1-(1H-Indol-6-yl)ethanone (CAS: 81223-73-6)?

The market for 1-(1H-Indol-6-yl)ethanone (CAS: 81223-73-6) is driven by its use in drug discovery and development, particularly in the synthesis of bioactive compounds and agrochemicals. Research trends indicate increasing interest in developing more efficient and environmentally friendly synthesis methods. Recent studies focus on the use of this compound in medicinal chemistry and its potential as a precursor in natural product synthesis.

How should waste containing 1-(1H-Indol-6-yl)ethanone (CAS: 81223-73-6) be handled?

Waste containing 1-(1H-Indol-6-yl)ethanone (CAS: 81223-73-6) should be collected in appropriate containers and stored in a well-ventilated area away from heat and ignition sources. Incineration is a common disposal method, but it must be performed in a specialized facility to minimize environmental impact. Professional waste disposal services should be utilized to ensure compliance with local regulations and safe disposal. Proper personal protective equipment (PPE) and safety measures must be in place during the handling and disposal process.