ChemicalBook--->CAS DataBase List--->5586-88-9

5586-88-9

5586-88-9 Structure

5586-88-9 Structure
IdentificationMore
[Name]

4-Chlorophenylacetone
[CAS]

5586-88-9
[Synonyms]

1-(4-CHLOROPHENYL)ACETONE
1-(4-CHLOROPHENYL)PROPAN-2-ONE
4'-CHLOROPHENYLACETONE
4-CHLOROPHENYLACETONE
P-CHLORO BENZYL METHYL KETONE
(P-CHLOROPHENYL)ACETONE
1-(p-chlorophenyl)acetone
2-Propanone, 1-(4-chlorophenyl)-
2-Propanone,1-(4-chlorophenyl)-
4-Chlorphenylaceton
P-CHLORO ENZYL METHYL KETONE
4-CHLOROPHENYLACETONE 98%
1-(4-Chlorophenyl)-2-propanone
4-Chlorophenylmethyl(methyl) ketone
[EINECS(EC#)]

226-986-4
[Molecular Formula]

C9H9ClO
[MDL Number]

MFCD00045214
[Molecular Weight]

168.62
[MOL File]

5586-88-9.mol
Chemical PropertiesBack Directory
[Appearance]

clear light yellow liquid
[Melting point ]

6-8 °C
[Boiling point ]

132 °C
[density ]

1.151
[refractive index ]

1.5325-1.5345
[Fp ]

>110℃
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

Liquid
[color ]

Clear light yellow
[InChI]

1S/C9H9ClO/c1-7(11)6-8-2-4-9(10)5-3-8/h2-5H,6H2,1H3
[InChIKey]

WEJRYKSUUFKMBC-UHFFFAOYSA-N
[SMILES]

CC(=O)Cc1ccc(Cl)cc1
[CAS DataBase Reference]

5586-88-9(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Propanone,p-chlorophenyl-(5586-88-9)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-52
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

WGK 3
[HS Code ]

29147000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Chronic 3
Hazard InformationBack Directory
[Chemical Properties]

clear light yellow liquid
[Uses]

4-Chlorophenylacetone is a phenylacetone derivative used in the preparation of biologically active compounds such as anorectic agents.
[Preparation]

At present, there are three main synthetic routes for 4-chlorophenylacetone. The first is to synthesize 4-chlorophenylacetone with sodium p-chlorobenzenesulfonate and acetone as raw materials, with a yield of about 54%. The second synthesis route is to synthesize 4-chlorophenylacetone with p-chlorobenzenesulfonyl chloride and chloroacetone as raw materials. The third synthesis route is to synthesize 4-chlorophenylacetone from chloroacetone.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 48, p. 2590, 1983 DOI: 10.1021/jo00163a034
[Health Hazard]

When it contacts with skin and mucous membrane, 4-chlorophenylacetone will cause inflammation, so pay attention to safety when using 4-chlorophenylacetone. This chemical is harmful to environment. It should be prevented from contacting groundwater, waterways or sewage systems. Without government permission, 4-chlorophenylacetone should not be discharged into the surrounding environment.
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Chlorophenylacetone, 98%(5586-88-9)
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