Methyl 4-methoxy-3-oxobutanoate

Basic Information

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CAS Number

41051-15-4

Molecular Formula

C6H10O4

Molecular Weight

146.14 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 Physical Properties

Melting Point

-80℃

Boiling Point

113°C/26mmHg

Refractive Index

n20/D 1.431(lit.)

SMILES

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COCC(=O)CC(=O)OC

InChI

InChI=1S/C6H10O4/c1-9-4-5(7)3-6(8)10-2/h3-4H2,1-2H3

InChIKey

QGBPKJFJAVDUNC-UHFFFAOYSA-N

LogP

-0.23499999999999988

Topological Polar Surface Area

52.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

130

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class Comb liq Class Comb liq

Synonyms & References

English

A825415
Methyl 4-methoxy-3-oxo-butanoate
BB 0304803
methyl 4-methoxy-acetoacetate
Methyl 4-methoxy-3-oxobutanoate #
4-methoxy-3-oxo-butyric acid methyl ester
Methyl 4-methoxy-3-oxobutyrate
methyl gamma-methoxyacetoacetate
F0001-1159
Methyl 4-methoxyacetoacetate
Methyl4-methoxyacetoacetate
SCHEMBL126506
Methyl methoxyacetoacetate
Methyl 4-methoxyacetoacetat
CS-W007767
Methyl 4-methoxyacetoacetate, 97%
methyl-4-methoxyacetoacetate
NS00030906
BCP17248
STR00554
FT-0628844
SY009587
Methyl 4-methoxy-3-oxobutanoate
Z104495598
gamma-methoxyacetoacetic acid methyl ester
InChI=1/C6H10O4/c1-9-4-5(7)3-6(8)10-2/h3-4H2,1-2H3
EINECS 255-188-9
MFCD00010183
PB47715
Methyl 4-(methyloxy)-3-oxobutanoate
4-Methoxy-3-oxobutyric acid methyl ester

MDL Number

MFCD00010183

Customs Code

2918990090

FAQ

What is Methyl 4-methoxy-3-oxobutanoate (CAS: 41051-15-4)?

Methyl 4-methoxy-3-oxobutanoate is an organic compound with the chemical formula C8H14O4. It is a methyl ester of 4-methoxy-3-oxobutanoic acid, characterized by its ester functional group and presence of a methoxy substituent. This compound is commonly used in chemical synthesis and research due to its reactivity and structural versatility.

What are the main uses of Methyl 4-methoxy-3-oxobutanoate (CAS: 41051-15-4)?

Methyl 4-methoxy-3-oxobutanoate is primarily used in pharmaceutical research for the synthesis of various drugs and intermediates. It also finds applications in the chemical industry for producing specialty chemicals and in research settings for developing new materials and compounds. Additionally, it may be used in some food-related applications as a flavor enhancer or additive, though this is less common.

Is Methyl 4-methoxy-3-oxobutanoate (CAS: 41051-15-4) safe?

Methyl 4-methoxy-3-oxobutanoate is generally considered safe when handled properly. However, as with many organic compounds, it may cause skin or eye irritation. Safety standards recommend using appropriate personal protective equipment (PPE) such as gloves and goggles during handling. It is important to follow standard chemical safety protocols to ensure safe use in laboratories and industrial environments.

How should Methyl 4-methoxy-3-oxobutanoate (CAS: 41051-15-4) be stored?

Methyl 4-methoxy-3-oxobutanoate should be stored in a cool, dry, and well-ventilated place away from direct sunlight. It is typically kept in tightly sealed containers to prevent moisture and air exposure. Storage conditions should maintain a temperature below 25°C and humidity levels below 60% to ensure stability and prolong shelf life.