Diethyl aminomalonate

Basic Information

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CAS Number

6829-40-9

Molecular Formula

C7H13NO4

Molecular Weight

175.18 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 Amines

Basic Physical Properties

Melting Point

88℃（0.53kPa）,200 °C at 760 mmHg

Boiling Point

306.47°C (rough estimate)

Density

1.1000

Flash Point

52.3 °C

Refractive Index

1.4353 (estimate)

SMILES

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CCOC(=O)C(C(=O)OCC)N

InChI

InChI=1S/C7H13NO4/c1-3-11-6(9)5(8)7(10)12-4-2/h5H,3-4,8H2,1-2H3

InChIKey

WLTCKEHCTUYJGI-UHFFFAOYSA-N

LogP

-0.5600999999999996

Topological Polar Surface Area

78.62 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

151

Synonyms & References

English

Diethyl2-aminomalonate
NCGC00335393-01
Diethyl aminomalonate
EN300-24015
Diethyl 2-aminomalonate
AMINOMALONIC ACID DIETHYL ESTER
CHEBI:165846
Propanedioic acid, amino-, diethyl ester
NSC-121992
AB00443476-03
W-104681
Diethyl aminopropanedioate
Diethyl 2-aminomalonate #
CCG-245161
NSC 121992
FT-0601119
DTXSID30987815
F8889-7946
Diethyl 2-aminomalonate, AldrichCPR
SCHEMBL338079
NSC121992
diethyl 2-aminopropanedioate
CS-0113084
2-Aminomalonic acid diethyl ester
6829-40-9
NS00081315
AKOS009086612
2-AMINO-MALONIC ACID DIETHYL ESTER
1,3-DIETHYL 2-AMINOPROPANEDIOATE
EINECS 229-905-0
diethyl aminomalonate

MDL Number

MFCD00130009

Customs Code

2922499990

FAQ

What regulatory guidelines apply to Diethyl aminomalonate (CAS: 6829-40-9)?

Diethyl aminomalonate (CAS: 6829-40-9) falls under various regulatory guidelines such as the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the EU, and FDA and EPA requirements in the United States. Specific handling, storage, and disposal procedures are mandated by these regulations to ensure safety and environmental protection.

Are there alternatives to Diethyl aminomalonate in synthesis?

In synthesis, alternatives to Diethyl aminomalonate include other amino acids, malonic acid derivatives, and various aminomalonate analogs. Isomers such as ethyl aminomalonate or other substituted aminomalonates can also be used depending on the specific reaction conditions and desired product.

What is the market or research trend for Diethyl aminomalonate?

The market for Diethyl aminomalonate (CAS: 6829-40-9) is driven by its use in pharmaceuticals, organic synthesis, and as a building block for polymers. Recent research trends focus on its applications in drug discovery, biosynthesis, and as a precursor in the development of new materials. Market trends indicate increasing demand due to its versatile chemical properties.

How should waste containing Diethyl aminomalonate (CAS: 6829-40-9) be handled?

Waste containing Diethyl aminomalonate (CAS: 6829-40-9) should be collected in appropriate containers and managed according to local regulations. It can be incinerated or disposed of through professional waste disposal services. Environmental protection precautions include proper containment to prevent spills and adhering to safety guidelines to avoid exposure to potentially hazardous chemicals.