2-Ethyl-3-methyl-1-benzofuran

Basic Information

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CAS Number

80079-25-0

Molecular Formula

C11H12O

Molecular Weight

160.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

240 ºC

Density

1.030

Flash Point

97 ºC

SMILES

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CCC1=C(C2=CC=CC=C2O1)C

InChI

InChI=1S/C11H12O/c1-3-10-8(2)9-6-4-5-7-11(9)12-10/h4-7H,3H2,1-2H3

InChIKey

XYFFYNXZBWDIPL-UHFFFAOYSA-N

LogP

3.3036200000000013

Topological Polar Surface Area

13.14 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

155

Synonyms & References

English

SCHEMBL10238814
FT-0757555
2-Ethyl-3-methyl-1-benzofuran
AKOS006307339
80079-25-0
DTXSID20507465
2-ETHYL-3-METHYLBENZOFURAN
2-Ethyl-3-methylbenzofuran
2-ethyl-3-methyl-1-benzofuran
2-Aethyl-3-methyl-benzofuran
3-Methyl-2-aethyl-cumaron
Benzofuran,2-ethyl-3-methyl
Benzofuran, 2-ethyl-3-methyl-

MDL Number

MFCD11044828

Customs Code

2932999099

FAQ

What is 2-Ethyl-3-methyl-1-benzofuran (CAS: 80079-25-0)?

2-Ethyl-3-methyl-1-benzofuran is a benzofuran derivative with the molecular formula C10H11O. It is a yellow, viscous liquid with a sweet, aromatic odor. This compound is used in various applications such as flavor and fragrance industries, research, and as a precursor in the synthesis of other organic compounds.

What are the main uses of 2-Ethyl-3-methyl-1-benzofuran (CAS: 80079-25-0)?

2-Ethyl-3-methyl-1-benzofuran is primarily used in the flavor and fragrance industry due to its sweet, aromatic properties. It is also used as a precursor in the synthesis of other organic compounds and has applications in research for its structural characteristics.

Is 2-Ethyl-3-methyl-1-benzofuran (CAS: 80079-25-0) safe?

2-Ethyl-3-methyl-1-benzofuran is generally considered safe for industrial use when handled with appropriate precautions. However, it is important to use personal protective equipment (PPE) such as gloves and goggles to avoid skin and eye contact. Avoid inhalation and ingestion. Storage should be in a cool, well-ventilated area, away from sources of heat and ignition.

How should 2-Ethyl-3-methyl-1-benzofuran (CAS: 80079-25-0) be stored?

2-Ethyl-3-methyl-1-benzofuran should be stored in a cool, dry place away from direct sunlight and sources of heat. It should be kept in a tightly sealed container to prevent evaporation and contamination. The storage area should be well-ventilated to ensure proper air circulation and safety.