(4-Fluorophenyl)acetone
- CAS NO.:459-03-0
- Empirical Formula: C9H9FO
- Molecular Weight: 152.17
- MDL number: MFCD00000362
- EINECS: 207-284-7
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-08-07 19:09:42
What is (4-Fluorophenyl)acetone?
Description
This intermediate, also known as (4-Fluorophenyl)acetone, 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
The Uses of (4-Fluorophenyl)acetone
4-Fluorophenylacetone is a haloarylacetone derivative used in a study of reversed enantiopreference of an ω-transaminase by a single-point mutation.
The Uses of (4-Fluorophenyl)acetone
4-Fluorophenylacetone 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.
What are the applications of 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.
Properties of (4-Fluorophenyl)acetone
Boiling point: | 106-107 °C/18 mmHg (lit.) |
Density | 1.139 g/mL at 25 °C (lit.) |
refractive index | n |
Flash point: | 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 |
CAS DataBase Reference | 459-03-0(CAS DataBase Reference) |
NIST Chemistry Reference | (4-Fluorophenyl)acetone(459-03-0) |
Safety information for (4-Fluorophenyl)acetone
Signal word | Warning |
Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H227:Flammable liquids |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
Computed Descriptors for (4-Fluorophenyl)acetone
InChIKey | ZUEKIIWSVFBTCM-UHFFFAOYSA-N |
SMILES | C(C1=CC=C(F)C=C1)C(=O)C |
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