Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate

Basic Information

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CAS Number

6413-10-1

Molecular Formula

C8H14O4

Molecular Weight

174.2 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 Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

98°C/12mmHg

Density

1.0817 (rough estimate)

Refractive Index

n20/D 1.431-1.435

SMILES

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CCOC(=O)CC1(C)OCCO1

InChI

InChI=1S/C8H14O4/c1-3-10-7(9)6-8(2)11-4-5-12-8/h3-6H2,1-2H3

InChIKey

XWEOGMYZFCHQNT-UHFFFAOYSA-N

LogP

0.7026000000000001

Topological Polar Surface Area

44.760000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

160

Safety Information

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GHS Hazard Pictograms

H227

Hazard Statement

H227 Combustible liquid
Flammable liquids

Synonyms & References

English

Ethyl 2-(2-methyl-1,3-dioxolan-2-yl)acetate
Jasmaprunat
Ketopommal
Apple essence
Fructone
2-Methyl-1,3-dioxolane-2-acetic acid, ethyl ester
Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate
o-Cresolphthalein
Ethyl 2-Methyl-1,3-dioxolane-2-acetate
Applinal
Ethyl 2-methyldioxolan-2-yl acetate
NSC 6537
2-(2-Methyl-1,3-dioxolan-2-yl)acetic Acid Ethyl Ester
Frutinal
Ethylfruitat
Methyldioxolan
Fragolan
2-Methyl-1,3-dioxolane-2-acetic acid ethyl ester
1,3-Dioxolane-2-acetic acid, 2-methyl-, ethyl ester
Ethyl acetoacetate ethylene ketal
Ethyl acetoacetate 3-ethylene acetal
G5EXI4NID0
Ethyl acetoacetate ethylene acetal
XWEOGMYZFCHQNT-UHFFFAOYSA-N
Ethyl 3-oxobutyrate ethylene ketal
Ethylacetoacetate ethyleneglycol
Ethyl 2-methyl-1,3-dioxolane-2-acetate

MDL Number

MFCD00152488

Customs Code

2932999099

FAQ

What regulatory guidelines apply to Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate (CAS: 6413-10-1)?

Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate (CAS: 6413-10-1) is classified under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) as a category 3 toxin. It is also subject to European Union REACH regulations, which require manufacturers and importers to register substances above a one-tonne threshold. Additionally, it is regulated by the EPA and FDA in the United States for environmental and safety considerations.

Are there alternatives to Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate (CAS: 6413-10-1) in synthesis?

Alternative reagents in synthesis include propyl (2-methyl-1,3-dioxolan-2-yl)acetate and butyl (2-methyl-1,3-dioxolan-2-yl)acetate. These compounds are structurally similar and can be used as substitutes depending on the specific requirements of the synthesis process.

What is the market or research trend for Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate (CAS: 6413-10-1)?

The market for Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate (CAS: 6413-10-1) is growing due to its use in fragrance and flavor industries. Research trends are focusing on its application in green chemistry and sustainable production methods. Additionally, there is increasing interest in its use as a precursor in the synthesis of other complex molecules.

How should waste containing Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate (CAS: 6413-10-1) be handled?

Waste containing Ethyl (2-methyl-1,3-dioxolan-2-yl)acetate (CAS: 6413-10-1) should be collected in properly labeled, leak-proof containers. It should then be disposed of through a professional waste disposal service that complies with local regulations. Environmental precautions include ensuring that the waste is not released into the environment and that proper incineration or chemical treatment methods are used to minimize environmental impact.