1,3-dimethyl 2-fluoropropanedioate

Basic Information

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CAS Number

344-14-9

Molecular Formula

C5H7FO4

Molecular Weight

150.11 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

Fine Chemicals Specialty Chemicals UV Stabilizers

Electronic Chemicals Semiconductor Materials Etchants

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Boiling Point

76 °C

Flash Point

111-112°C/45mm

Refractive Index

1.4032

SMILES

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COC(=O)C(C(=O)OC)F

InChI

InChI=1S/C5H7FO4/c1-9-4(7)3(6)5(8)10-2/h3H,1-2H3

InChIKey

ZVXHZSXYHFBIEW-UHFFFAOYSA-N

LogP

-0.3295000000000001

Topological Polar Surface Area

52.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

129

Safety Information

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Hazard Statement

Hazard Class

Class 8 Class 8

Synonyms & References

English

Z99599894
dimethyl 2-fluoropropanedioate
1,3-dimethyl 2-fluoropropanedioate
HMS1745A18
propanedioic acid, 2-fluoro-, 1,3-dimethyl ester
dimethyl fluoropropanedioate
FT-0625079
dimethyl 2-fluoromalonate
C5H7FO4
MFCD00054680
A6063
AKOS001105957
DTXSID60371844
2-fluoro-propanedioic acid dimethyl ester
DIMETHYL FLUOROMALONATE
dimethyl alpha-fluoromalonate
2-fluoro-malonic acid dimethyl ester
EN300-14293
Propanedioic acid, fluoro-, dimethyl ester
dimethylfluoromalonate
ZVXHZSXYHFBIEW-UHFFFAOYSA-N
SCHEMBL19492
dimethyl2-fluoromalonate
J-520370
CS-0020165
methyl 2-fluoro-4-methoxyacetoacetate
344-14-9
AS-20062
AMY6801
Dimethyl fluoromalonate
Fluoromalonic acid dimethyl ester

MDL Number

MFCD00054680

Customs Code

2917190090

FAQ

What regulatory guidelines apply to 1,3-dimethyl 2-fluoropropanedioate (CAS: 344-14-9)?

1,3-Dimethyl 2-fluoropropanedioate (CAS: 344-14-9) is subject to various regulatory guidelines. In the European Union, it is covered by REACH regulations, which require companies to register substances above one tonne per year. Globally, it falls under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which includes specific health and environmental hazards. Additionally, it is regulated by the U.S. Food and Drug Administration (FDA) and the U.S. Environmental Protection Agency (EPA) in terms of safety and environmental impact.

Are there alternatives to 1,3-dimethyl 2-fluoropropanedioate (CAS: 344-14-9) in synthesis?

There are several alternatives to 1,3-dimethyl 2-fluoropropanedioate (CAS: 344-14-9) for synthesis, including 1,3-dimethylpropanedioate and 2-fluoropropanoic acid methyl ester. These alternatives may offer similar functional groups and reactivity in synthetic processes. However, the choice of alternative depends on specific reaction conditions and desired product properties.

What is the market or research trend for 1,3-dimethyl 2-fluoropropanedioate (CAS: 344-14-9)?

The market for 1,3-dimethyl 2-fluoropropanedioate (CAS: 344-14-9) is driven by its applications in pharmaceuticals and agrochemicals. Research trends are focusing on its use as a key intermediate in the synthesis of specialty chemicals and active pharmaceutical ingredients (APIs). The market is expected to grow with increasing demand from these sectors. Additionally, there is a growing interest in its potential as a green chemical due to its environmental profile.

How should waste containing 1,3-dimethyl 2-fluoropropanedioate (CAS: 344-14-9) be handled?

Waste containing 1,3-dimethyl 2-fluoropropanedioate (CAS: 344-14-9) should be handled according to local and international regulations. It is important to collect and store waste in appropriate containers, ensuring they are labeled with the correct hazard information. For disposal, it is recommended to use professional waste disposal services that comply with environmental protection standards. Incineration may be suitable for complete destruction, but careful consideration of local regulations and environmental impact is necessary.