3-(Methylsulfanyl)propyl acetate

Basic Information

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CAS Number

16630-55-0

Molecular Formula

C6H12O2S

Molecular Weight

148.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Boiling Point

96°C/14mmHg

Density

1.0410

Flash Point

84.5°C

Refractive Index

1.4610-1.4650

SMILES

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CC(=O)OCCCSC

InChI

InChI=1S/C6H12O2S/c1-6(7)8-4-3-5-9-2/h3-5H2,1-2H3

InChIKey

LPZQTNIAYMRVMF-UHFFFAOYSA-N

LogP

1.3026

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

83.1

Safety Information

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GHS Hazard Pictograms

H227

Hazard Statement

H227 Combustible liquid
Flammable liquids

Synonyms & References

English

3-(methylthio)propyl acetate
3-methylsulfanylpropyl acetate
Acetic Acid 3-(Methylthio)propyl Ester
1-Propanol,3-(methylthio)-, acetate (8CI,9CI)
3-Acetoxypropyl methyl sulfide
Methionyl acetate
FEMA 3883
Einecs 240-679-2
methionol acetate
3-MEHTYLTHIO PROPYL ACETATE
3-(METHYLTHIO)-1-PROPANOACETATE
3-(Methylsulfanyl)propyl acetate
3-(methylthio)-1-Propanol acetate
3-(Methylmercapto)-propyl acetate
3-Methylthiopropyl acetate
1-Propanol, 3-(methylthio)-, acetate
IGN6YR3CJE
3-Methylthio propyl acetate
KSC497G9T
Jsp003346
LPZQTNIAYMRVMF-UHFFFAOYSA-N
VZ27118

MDL Number

MFCD00053113

FAQ

What regulatory guidelines apply to 3-(Methylsulfanyl)propyl acetate (CAS: 16630-55-0)?

3-(Methylsulfanyl)propyl acetate (CAS: 16630-55-0) falls under various regulatory guidelines including GHS classification for hazardous chemicals, REACH regulations for identification, labeling, and safety assessment, and FDA/EPA-related requirements for safety and environmental impact. Companies must ensure compliance with these regulations to avoid legal and environmental issues.

Are there alternatives to 3-(Methylsulfanyl)propyl acetate in synthesis (CAS: 16630-55-0)?

Alternatives to 3-(Methylsulfanyl)propyl acetate in synthesis include similar functional groups such as 3-(ethylsulfanyl)propyl acetate or other ester derivatives. Isomers like 2-(methylthio)butyl acetate can also be considered. Common alternative reagents might include different acylating agents or thioether compounds, providing flexibility in chemical synthesis strategies.

What is the market or research trend for 3-(Methylsulfanyl)propyl acetate (CAS: 16630-55-0)?

The market and research for 3-(Methylsulfanyl)propyl acetate is expanding due to its applications in fragrances and flavorings. Research trends include exploring its use in food additives and cosmetic formulations. Market demand is growing, driven by increasing consumer preference for natural products, though cost fluctuations can influence market dynamics.

How should waste containing 3-(Methylsulfanyl)propyl acetate (CAS: 16630-55-0) be handled?

Waste containing 3-(Methylsulfanyl)propyl acetate should be collected in appropriate containers and stored in a well-ventilated area. Proper incineration or professional waste disposal services are recommended to ensure safe disposal. Environmental protection measures include minimizing spillage and ensuring waste is not released into the environment, following local waste management regulations.