Ethyl 4-oxotetrahydrofuran-3-carboxylate

Basic Information

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CAS Number

89898-51-1

Molecular Formula

C7H10O4

Molecular Weight

158.15 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

Boiling Point

237 ºC

Density

1.213

Flash Point

99 ºC

SMILES

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CCOC(=O)C1COCC1=O

InChI

InChI=1S/C7H10O4/c1-2-11-7(9)5-3-10-4-6(5)8/h5H,2-4H2,1H3

InChIKey

BNXOKRMYIMMSKY-UHFFFAOYSA-N

LogP

-0.2350000000000001

Topological Polar Surface Area

52.6 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

175

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Synonyms & References

English

Ethyl 4-oxotetrahydrofuran-3-carboxylate
ethyl 4-oxooxolane-3-carboxylate
Tetrahydro-4-oxo-3-furoic acid ethyl ester
3-Furancarboxylic acid, tetrahydro-4-oxo-, ethyl ester
BNXOKRMYIMMSKY-UHFFFAOYSA-N
4919AC
FCH1137027
AB70736
SY046087
AX8236932
ST24047052
3-Furancarboxylic acid,tetrahydro-4-oxo-,ethyl ester
4-Oxo-tetrahydro-furan-3-carboxylic acid ethyl ester
3-Furoic acid, tetrahydro-4-oxo-, ethyl ester (7CI)
Ethyl tetrahydro-4-oxo-3-furancarboxylate (ACI)
4-Oxotetrahydrofuran-3-carboxylic acid ethyl ester
CS-W001012
DB-343009
DS-16538
ETHYL 4-OXOOXOLANE-3-CARBOXYLATE
DTXSID50618654
Ethyl4-oxotetrahydrofuran-3-carboxylate
AKOS015995489
MFCD16038834
89898-51-1
SCHEMBL2710439

MDL Number

MFCD16038834

FAQ

What is Ethyl 4-oxotetrahydrofuran-3-carboxylate (CAS: 89898-51-1)?

Ethyl 4-oxotetrahydrofuran-3-carboxylate (CAS: 89898-51-1) is a cyclic ester with the molecular formula C7H10O4. It is a colorless to light yellow liquid with a mild, characteristic odor. This compound is used in various applications including pharmaceuticals and as a chemical intermediate.

What are the main uses of Ethyl 4-oxotetrahydrofuran-3-carboxylate (CAS: 89898-51-1)?

Ethyl 4-oxotetrahydrofuran-3-carboxylate (CAS: 89898-51-1) is primarily used as a precursor in the synthesis of other compounds. It finds applications in the pharmaceutical industry, where it serves as a building block for drug development. Additionally, it is used in the formulation of certain chemical products and as a reagent in organic synthesis.

Is Ethyl 4-oxotetrahydrofuran-3-carboxylate (CAS: 89898-51-1) safe?

Ethyl 4-oxotetrahydrofuran-3-carboxylate (CAS: 89898-51-1) is generally considered safe when used under recommended conditions. However, it is important to handle it with appropriate personal protective equipment (PPE) such as gloves and goggles. Exposure to high concentrations may cause irritation. Follow all safety guidelines provided by the manufacturer.

How should Ethyl 4-oxotetrahydrofuran-3-carboxylate (CAS: 89898-51-1) be stored?

Ethyl 4-oxotetrahydrofuran-3-carboxylate (CAS: 89898-51-1) should be stored in a cool, dry place away from direct sunlight and heat sources. Store it in a tightly sealed container to prevent moisture absorption. Avoid keeping it in areas with high humidity or temperature fluctuations. Keep it out of reach of children and pets and ensure proper ventilation during storage and handling.