Dimethyl acetamidomalonate

Basic Information

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CAS Number

60187-67-9

Molecular Formula

C7H11NO5

Molecular Weight

189.17 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

SMILES

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CC(=O)NC(C(=O)OC)C(=O)OC

InChI

InChI=1S/C7H11NO5/c1-4(9)8-5(6(10)12-2)7(11)13-3/h5H,1-3H3,(H,8,9)

InChIKey

CHQXZPUFDGYORW-UHFFFAOYSA-N

LogP

-1.1628999999999992

Topological Polar Surface Area

81.69999999999999 Å²

Hydrogen Bond Donor/Acceptor

1 / 6

Complexity

209

Synonyms & References

English

Dimethyl 2-acetamidomalonate
CHQXZPUFDGYORW-UHFFFAOYSA-N
NSC-157352
dimethyl acetamidomalonate
dimethyl 2-acetamidopropanedioate
DTXSID50303210
NSC157352
60187-67-9
AMY37211
BS-22356
FT-0656870
A51098
SCHEMBL1471075
AKOS006273268
CS-0209098
ACETYLAMINOMALONIC ACID DIMETHYLESTER
2-(ACETAMIDO)MALONATE
DIMETHYL ACETAMIDOMALONATE
acetylamino-malonic acid dimethyl ester
Acetylamino-malonsaeure-dimethylester
dimethyl acetylaminomalonate
Malonicacid, acetamido-, dimethyl ester (6CI)
Propanedioic acid, (acetylamino)-,dimethyl ester (9CI)
(Acetylamino)propanedioic acid dimethyl ester
Dimethyl(acetylamino)malonate
Dimethyl 2-(acetylamino)malonate
Dimethylacetamidomalonate
NSC 157352

MDL Number

MFCD00066307

Customs Code

2924199090

FAQ

What are the physical and chemical properties of Dimethyl acetamidomalonate (CAS: 60187-67-9)?

Dimethyl acetamidomalonate (CAS: 60187-67-9) is a white crystalline solid with a molecular weight of approximately 204.24 g/mol. It is slightly soluble in water and has a pKa of 5.5. This compound is susceptible to hydrolysis and has limited reactivity in the presence of strong acids or bases. It is stable under normal conditions but should be stored in a cool, dry place away from direct sunlight.

How is Dimethyl acetamidomalonate (CAS: 60187-67-9) typically synthesized?

Dimethyl acetamidomalonate (CAS: 60187-67-9) is typically synthesized through the amidation of malonoyl chloride with dimethylamine. The reaction involves the condensation of malonoyl chloride with dimethylamine in the presence of an appropriate base, such as pyridine. The yield and selectivity of the reaction can be enhanced by using anhydrous conditions and appropriate catalysts.

What industries use Dimethyl acetamidomalonate (CAS: 60187-67-9)?

Dimethyl acetamidomalonate (CAS: 60187-67-9) is utilized in various industries, including pharmaceuticals, where it serves as a precursor for the synthesis of certain drugs; polymers, where it can act as a monomer or cross-linking agent; and sensors, where it can be used as a component in sensor materials. Its applications in semiconductors and other advanced materials are also being explored.

What precautions should be taken when handling Dimethyl acetamidomalonate (CAS: 60187-67-9)?

When handling Dimethyl acetamidomalonate (CAS: 60187-67-9), it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to minimize exposure to airborne particles. In case of a spill, it should be cleaned up using appropriate procedures, and the area should be properly decontaminated. Always refer to the Safety Data Sheet (SDS) for detailed safety information.