5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione

Basic Information

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CAS Number

72324-39-1

Molecular Formula

C8H10O5

Molecular Weight

186.16 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 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

Melting Point

83-84 ºC(dec.)

Density

1.231

SMILES

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CC(=O)C1C(=O)OC(OC1=O)(C)C

InChI

InChI=1S/C8H10O5/c1-4(9)5-6(10)12-8(2,3)13-7(5)11/h5H,1-3H3

InChIKey

BTJDMDJIAAHSRG-UHFFFAOYSA-N

LogP

0.027699999999999836

Topological Polar Surface Area

69.67000000000002 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

258

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

1,3-Dioxane-4,6-dione, 5-acetyl-2,2-dimethyl-
SCHEMBL1012423
1D-012
MFCD03425724
J-516617
FT-0680112
DTXSID00376974
72324-39-1
CS-0455221
5-acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione
AKOS005069678
BTJDMDJIAAHSRG-UHFFFAOYSA-N
E86959
5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione
1,3-Dioxane-4,6-dione,5-acetyl-2,2-dimethyl-
5-acetyl-2,2-dimethyl-[1,3]dioxane-4,6-dione
2,2-dimethyl-4,6-dioxo-5-acetyl-1,3-dioxane
5-acetyl-2,2-dimethyl-4,6-dioxo-1,3-dioxane
5-acetyl-Meldrum's acid
acetyl Meldrum's acid
acetyldimethyldioxanedione
meldrums acid

MDL Number

MFCD03425724

FAQ

What is 5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS: 72324-39-1)?

5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione is a cyclic ketone with the molecular formula C8H8O4. It is a colorless to light yellow liquid with a distinctive odor. This compound is characterized by its aromatic and dioxane-like properties.

What are the main uses of 5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS: 72324-39-1)?

5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione is mainly used in the synthesis of pharmaceuticals, as a reagent in organic chemistry, and in the preparation of certain dyes and pigments. It is also utilized in the production of agrochemicals and in research applications.

Is 5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS: 72324-39-1) safe?

5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione can be safe if handled properly. However, it is important to use appropriate personal protective equipment, such as gloves, goggles, and lab coats, when working with this compound. It is a flammable liquid and may cause skin and eye irritation. Proper ventilation should be maintained at all times.

How should 5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS: 72324-39-1) be stored?

5-Acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed container made of appropriate materials to prevent degradation. The container should be tightly closed to prevent evaporation and contamination. Avoid storing it near incompatible materials such as strong acids or oxidizers.