1-(4-Fluorophenyl)acetone

Basic Information

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CAS Number

459-03-0

Molecular Formula

C9H9FO

Molecular Weight

152.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

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

Boiling Point

130°C/30mmHg

Refractive Index

n20/D 1.496(lit.)

SMILES

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

InChI

InChI=1S/C9H9FO/c1-7(11)6-8-2-4-9(10)5-3-8/h2-5H,6H2,1H3

InChIKey

ZUEKIIWSVFBTCM-UHFFFAOYSA-N

LogP

1.9572

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

137

Safety Information

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GHS Hazard Pictograms

H227

Hazard Statement

H227 Combustible liquid
Flammable liquids

Hazard Class

Class IRRITANT Class IRRITANT

Class FLAMMABLE Class FLAMMABLE

Synonyms & References

English

(4-Fluorophenyl)acetone
(4-Fluorophenyl)acetone, purum, >=97.0% (GC)
AKOS000216017
W-106113
4'-fluorophenylacetone
1-Acetonyl-4-fluorobenzene
4-fluorophenyl acetone
1-(4-fluorophenyl)propan-2-one;(4-Fluorophenyl)acetone
PD151210
DTXSID70196641
P-fluoro enzyl methyl ketone
1-(4-fluorophenyl)propan-2-one
1-(4-Fluorophenyl)acetone #
(4-Fluorophenyl)acetone, 98%
(4-fluorophenyl) acetone
EN300-55049
SCHEMBL48545
A826923
2-Propanone, 1-(4-fluorophenyl)-
2-Propanone, 1-[4-fluorophenyl]-
AM20060394
MFCD00000362
CL9158
1-(4-fluorophenyl)-2-propanone
4-Fluorophenylacetone
CS-W001916
PS-8920
F0535
NS00043016
FT-0605718
459-03-0

MDL Number

MFCD00000362

Customs Code

29147090

FAQ

What are the physical and chemical properties of 1-(4-Fluorophenyl)acetone (CAS: 459-03-0)?

1-(4-Fluorophenyl)acetone (CAS: 459-03-0) is a colorless to yellow liquid. It has a molecular weight of approximately 163.15 g/mol and a melting point of -21°C. The compound is moderately soluble in water but highly soluble in organic solvents. It exhibits good reactivity, particularly with nucleophiles and hydrogen acceptors, making it a versatile intermediate in synthetic chemistry.

How is 1-(4-Fluorophenyl)acetone (CAS: 459-03-0) typically synthesized?

1-(4-Fluorophenyl)acetone can be synthesized by the reaction of 4-fluorophenol with acetic anhydride. This process is catalyzed by an acid, such as concentrated sulfuric acid, and typically yields a product with a yield of around 85%. The reaction is known for its good selectivity and efficiency.

What industries use 1-(4-Fluorophenyl)acetone (CAS: 459-03-0)?

1-(4-Fluorophenyl)acetone (CAS: 459-03-0) is used extensively in the pharmaceutical industry for the synthesis of various active pharmaceutical ingredients. It also finds applications in the production of polymers, sensors, and semiconductors due to its functional groups that facilitate cross-linking and electronic properties.

What precautions should be taken when handling 1-(4-Fluorophenyl)acetone (CAS: 459-03-0)?

When handling 1-(4-Fluorophenyl)acetone (CAS: 459-03-0), it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. This compound should be used in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up using appropriate absorbents, and the material safety data sheet (MSDS) should always be consulted for detailed safety guidelines.