5-Hydroxy-4-octanone

Basic Information

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CAS Number

496-77-5

Molecular Formula

C8H16O2

Molecular Weight

144.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Physical Properties

Melting Point

-10°C

Boiling Point

96°C/20mmHg

Flash Point

79 ºC

Refractive Index

1.4315

SMILES

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CCCC(C(O)CCC)=O

InChI

InChI=1S/C8H16O2/c1-3-5-7(9)8(10)6-4-2/h7,9H,3-6H2,1-2H3

InChIKey

BVEYJWQCMOVMAR-UHFFFAOYSA-N

LogP

1.5166

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

99.4

Safety Information

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GHS Hazard Pictograms

H227

Hazard Statement

H227 Combustible liquid
Flammable liquids

Synonyms & References

English

5-Hydroxyoctan-4-one
5-Hydroxy-4-octanone
Butyroin

MDL Number

MFCD00021928

Customs Code

2914400090

FAQ

What regulatory guidelines apply to 5-Hydroxy-4-octanone (CAS: 496-77-5)?

5-Hydroxy-4-octanone (CAS: 496-77-5) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), and falls under the European Union's Registration, Evaluation, Authorisation, and Restriction of Chemicals (REACH) regulations. It is also subject to regulations by the Food and Drug Administration (FDA) and the Environmental Protection Agency (EPA) in the United States. For specific handling and labeling requirements, consult the relevant regulatory guidelines and safety data sheets (SDS).

Are there alternatives to 5-Hydroxy-4-octanone (CAS: 496-77-5) in synthesis?

There are several alternatives to 5-Hydroxy-4-octanone (CAS: 496-77-5) in synthesis, including 4-Hydroxy-5-octanone and 6-Hydroxy-4-octanone. Common alternative reagents include hydroxylation catalysts and other aldehyde precursors. It's important to consider the specific application and properties of these alternatives to determine the most suitable one for your synthesis needs.

What is the market or research trend for 5-Hydroxy-4-octanone (CAS: 496-77-5)?

The market for 5-Hydroxy-4-octanone (CAS: 496-77-5) is steadily growing, driven by its applications in fragrances, flavorings, and as a precursor in various chemical syntheses. Research trends focus on exploring its potential in new applications, such as in cosmetic and pharmaceutical industries. The market is also influenced by price trends and sustainability concerns, leading to a push for more environmentally friendly alternatives and production methods.

How should waste containing 5-Hydroxy-4-octanone (CAS: 496-77-5) be handled?

Waste containing 5-Hydroxy-4-octanone (CAS: 496-77-5) should be collected and disposed of according to local and international regulations. Proper waste management involves ensuring that waste is not released into the environment, and it should be handled using appropriate safety precautions. For professional disposal, contact certified waste management services. Always consult the Material Safety Data Sheet (MSDS) for specific disposal procedures and local regulatory requirements.