ChemicalBook--->CAS DataBase List--->459-03-0

459-03-0

459-03-0 Structure

459-03-0 Structure
IdentificationMore
[Name]

4-Fluorophenylacetone
[CAS]

459-03-0
[Synonyms]

1-(4-FLUOROPHENYL)-2-PROPANONE
1-ACETONYL-4-FLUOROBENZENE
4'-FLUOROPHENYLACETONE
4-FLUOROPHENYLACETONE
P-FLUORO BENZYL METHYL KETONE
(P-FLUOROPHENYL)ACETONE
1-(4-Fluorophenyl)acetone
2-Propanone, 1-(4-fluorophenyl)-
P-FLUORO ENZYL METHYL KETONE
4-Fluorophenylacetone,99%
4-Fluorophenylacetone 98%
4-Fluorophenylacetone98%
1-(2-Oxopropyl)-4-fluorobenzene
[EINECS(EC#)]

207-284-7
[Molecular Formula]

C9H9FO
[MDL Number]

MFCD00000362
[Molecular Weight]

152.17
[MOL File]

459-03-0.mol
Chemical PropertiesBack Directory
[Appearance]

clear yellow liquid
[Boiling point ]

106-107 °C/18 mmHg (lit.)
[density ]

1.139 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.496(lit.)
[Fp ]

197 °F
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Methyl Acetate: 50 mg/ml
[form ]

clear liquid
[color ]

Light yellow to Yellow to Orange
[Specific Gravity]

1.139
[Water Solubility ]

insoluble
[BRN ]

1936697
[InChI]

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

ZUEKIIWSVFBTCM-UHFFFAOYSA-N
[SMILES]

C(C1=CC=C(F)C=C1)C(=O)C
[CAS DataBase Reference]

459-03-0(CAS DataBase Reference)
[NIST Chemistry Reference]

(4-Fluorophenyl)acetone(459-03-0)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H227
[Precautionary statements ]

P210-P280-P403+P235-P501-P210e-P280a-P370+P378a-P501a
[Hazard Codes ]

F,Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

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

3
[Hazard Note ]

Flammable
[HazardClass ]

IRRITANT, FLAMMABLE
[HS Code ]

29147090
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

4-Fluorophenylacetone(459-03-0).msds
Hazard InformationBack Directory
[Description]

This intermediate, also known as 4-Fluorophenylacetone, presents as a dark yellow liquid. It is known to be insoluble in water. For best results, store in a tightly closed container in a dry and well-ventilated place. Containers which are opened must be carefully resealed and kept upright to prevent leakage. 4-Fluorophenylacetone is incompatible with strong oxidizing agents. This chemical is a combustible liquid.
[Chemical Properties]

clear yellow liquid
[Uses]

4-Fluorophenylacetone(459-03-0) is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff fields. It is a haloarylacetone derivative used in a study of reversed enantiopreference of an ω-transaminase by a single-point mutation.
[Application]

(4-Fluorophenyl)acetone is a phenylacetic acid derivative that inhibits the 5-HT2 receptors. It has been shown to have inhibitory activities against dopamine and serotonin by acting as an agonist at the receptor. (4-Fluorophenyl)acetone also binds to nucleophilic sites on proteins, which may lead to inhibition of protein synthesis. Brevibacterium sp. strain P7 was used as a model system and it has found that it inhibited the growth of this bacterium by binding to the enzyme RNA polymerase, preventing transcription and replication.
[Synthesis]

4-Fluorophenyl acetone synthesis methods are mainly the following: (1) 4-fluorophenyl derivatives and acetone in the presence of catalysts such as manganese acetate to obtain; (2) α-cyanoacetone-based m-fluorobenzene and sulfuric acid reaction can also be
Spectrum DetailBack Directory
[Spectrum Detail]

4-Fluorophenylacetone(459-03-0)MS
4-Fluorophenylacetone(459-03-0)1HNMR
4-Fluorophenylacetone(459-03-0)13CNMR
4-Fluorophenylacetone(459-03-0)IR1
4-Fluorophenylacetone(459-03-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Fluorophenylacetone, 98%(459-03-0)
[Alfa Aesar]

4-Fluorophenylacetone, 99%(459-03-0)
[Sigma Aldrich]

459-03-0(sigmaaldrich)
[TCI AMERICA]

(4-Fluorophenyl)acetone,>98.0%(GC)(459-03-0)
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