Ethyl (4-fluorophenyl)acetate

Basic Information

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CAS Number

587-88-2

Molecular Formula

C10H11FO2

Molecular Weight

182.19 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 Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Physical State

Solid

Melting Point

30°C

SMILES

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CCOC(=O)CC1=CC=C(C=C1)F

InChI

InChI=1S/C10H11FO2/c1-2-13-10(12)7-8-3-5-9(11)6-4-8/h3-6H,2,7H2,1H3

InChIKey

VMWJHHAOVXQCLE-UHFFFAOYSA-N

LogP

1.9313

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

162

Safety Information

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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

Synonyms & References

English

Ethyl (p-fluorophenyl)acetate
4-FLUOROPHENYLACETIC ACID ETHYL ESTER
FT-0736188
SCHEMBL1626240
(4-Flurophenyl)acetic acid ethyl ester
Z53835949
AKOS005259153
Ethyl2-(4-fluorophenyl)acetate
MFCD08235152
Ethyl 4-fluorophenylacetate
AR2996
(4-fluorophenyl)acetic acid ethyl ester
A832022
ethyl 2-(4-fluorophenyl)acetate
ethyl (4-fluorophenyl)acetate
DTXSID90207400
587-88-2
GS-4515
EN300-130231
Benzeneacetic acid, 4-fluoro-, ethyl ester
VMWJHHAOVXQCLE-UHFFFAOYSA-N
AM82987
CS-W022645
(4-Flurophenyl) acetic acid ethyl ester
SY021383
Ethyl 4-fluorobenzeneacetate
J-501410
Acetic acid, (p-fluorophenyl)-, ethyl ester
ethyl p-fluorophenylacetate
Ethyl 2-(4-fluorophenyl)acetate
4-Fluorophenylacetic Acid Ethyl Ester

MDL Number

MFCD08235152

FAQ

What are the physical and chemical properties of Ethyl (4-fluorophenyl)acetate (CAS: 587-88-2)?

Ethyl (4-fluorophenyl)acetate, CAS 587-88-2, is a colorless to light yellow liquid with a pineapple-like aroma. It has a molecular weight of approximately 184.17 g/mol. This compound is slightly soluble in water but readily soluble in organic solvents such as ethanol and acetone. It is moderately reactive, susceptible to hydrolysis, and can undergo ester exchange reactions under certain conditions.

How is Ethyl (4-fluorophenyl)acetate (CAS: 587-88-2) typically synthesized?

Ethyl (4-fluorophenyl)acetate is typically synthesized via the reaction of 4-fluorophenol with acetyl chloride in the presence of a base such as sodium hydroxide. This process involves the formation of an acylated intermediate, followed by the elimination of water to form the desired ester. The synthesis is carried out with high selectivity and yield, making it a common method in laboratory and industrial settings.

What industries use Ethyl (4-fluorophenyl)acetate (CAS: 587-88-2)?

Ethyl (4-fluorophenyl)acetate, CAS 587-88-2, is used in various industries. In the pharmaceutical industry, it serves as a precursor for the synthesis of certain drugs. In the polymer industry, it can be used as a monomer or a modifier. Additionally, it finds application in the production of fragrances, flavorings, and as a solvent or intermediate in the manufacturing of sensors and semiconductors.

What precautions should be taken when handling Ethyl (4-fluorophenyl)acetate (CAS: 587-88-2)?

When handling Ethyl (4-fluorophenyl)acetate, CAS 587-88-2, it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a cool, dry place, away from heat sources and incompatible materials. Spills should be handled with care, using appropriate absorbents, and the area should be ventilated. Always consult the Safety Data Sheet (SDS) for detailed safety information and emergency procedures.