2-Ethoxy-4-formylphenyl acetate

Basic Information

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CAS Number

72207-94-4

Molecular Formula

C11H12O4

Molecular Weight

208.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

303.9°C at 760 mmHg

Density

1.0627 (rough estimate)

Water Solubility

Soluble in water (986.4 mg / L) at 25°C.

Refractive Index

1.4389 (estimate)

SMILES

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CCOc1cc(C=O)ccc1OC(=O)C

InChI

InChI=1S/C11H12O4/c1-3-14-11-6-9(7-12)4-5-10(11)15-8(2)13/h4-7H,3H2,1-2H3

InChIKey

XRZFVPCFHPIMAD-UHFFFAOYSA-N

LogP

1.8231

Topological Polar Surface Area

52.6 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

227

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Sensitiveness

Air Sensitive

Synonyms & References

English

4-Acetoxy-3-ethoxybenzaldehyde
(2-ethoxy-4-formylphenyl) acetate
2-Ethoxy-4-formylphenyl acetate
2-ETHOXY-4-FORMYL-PHENYL ACETATE
4-Acetoxy-3-aethoxy-benzaldehyd
4-formyl-2-ethoxyphenyl ethanoate
Ethyl vanillin acetate
vanillal acetate
Benzaldehyde, 4-(acetyloxy)-3-ethoxy-
(2-ethoxy-4-formyl-phenyl) acetate
ethyl-vanillin-acetate
ethyl vanilline acetate
4-(Acet
Ethylvanillin acetate

MDL Number

MFCD01666413

Customs Code

2915390090

FAQ

What are the physical and chemical properties of 2-Ethoxy-4-formylphenyl acetate (CAS: 72207-94-4)?

2-Ethoxy-4-formylphenyl acetate (CAS: 72207-94-4) is a colorless to light yellow liquid. Its molecular weight is approximately 224.28 g/mol. The compound is slightly soluble in water but miscible with common organic solvents. It is moderately reactive towards nucleophiles and can undergo esterification and cleavage reactions. It has a boiling point of around 180°C and a melting point of around -20°C.

How is 2-Ethoxy-4-formylphenyl acetate (CAS: 72207-94-4) typically synthesized?

2-Ethoxy-4-formylphenyl acetate is typically synthesized via the acetylation of 2-ethoxy-4-formylphenol using acetic anhydride in the presence of a catalytic amount of an acid such as sulfuric acid. The reaction is carried out at room temperature, and the product is isolated by distillation or recrystallization. This process is selective and provides a high yield of the desired compound.

What industries use 2-Ethoxy-4-formylphenyl acetate (CAS: 72207-94-4)?

2-Ethoxy-4-formylphenyl acetate (CAS: 72207-94-4) is utilized in the pharmaceutical industry for the synthesis of certain drugs. It also finds applications in the production of polymers and as a precursor in the development of new materials for sensors and semiconductors. Its unique chemical structure allows for its use in these specialized applications.

What precautions should be taken when handling 2-Ethoxy-4-formylphenyl acetate (CAS: 72207-94-4)?

When handling 2-Ethoxy-4-formylphenyl acetate (CAS: 72207-94-4), it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The substance should be handled in a well-ventilated area or in a fume hood to minimize inhalation risks.Spills should be cleaned up using absorbent materials and disposed of according to local regulations. For detailed safety information, refer to the Material Safety Data Sheet (MSDS/SDS).