Alpha-bromo-3'-acetoxyacetophenone

Basic Information

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CAS Number

38396-89-3

Molecular Formula

C10H9BrO3

Molecular Weight

257.08 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CC(=O)OC1=CC=CC(=C1)C(=O)CBr

InChI

InChI=1S/C10H9BrO3/c1-7(12)14-9-4-2-3-8(5-9)10(13)6-11/h2-5H,6H2,1H3

InChIKey

YLJZSPJKMBFLRA-UHFFFAOYSA-N

LogP

2.1895

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

227

Synonyms & References

English

DTXSID50632597
3-(Bromoacetyl)phenyl acetate
[3-(2-bromoacetyl)phenyl] acetate
3-(2-BROMOACETYL)PHENYL ACETATE
ALPHA-BROMO-3'-ACETOXYACETOPHENONE
SCHEMBL8050505
2-Bromo-3-Acetoxy Acetophenone
FT-0736656
m-acetoxy-alpha-bromoacetophenone
38396-89-3
AKOS008901358
2-BROMO-3'-ACETYLOXYLACETOPHENONE
Ethanone,1-[3-(acetyloxy)phenyl]-2-bromo-
2-Bromo-3'-acetyloxylacetophenone
3'-Acetoxy-2-Bromoacetophenone
Acetophenone,2-bromo-3'-hydroxy-, acetate (7CI)

MDL Number

MFCD00045042

FAQ

What are the physical and chemical properties of Alpha-bromo-3'-acetoxyacetophenone (CAS: 38396-89-3)?

Alpha-bromo-3'-acetoxyacetophenone is a colorless to white crystalline solid with a molecular weight of approximately 291.07 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and acetone. This compound is highly reactive due to the presence of the bromine and acetoxy groups, displaying typical electrophilic properties. It is often used in organic synthesis and as a reagent in chemical reactions.

How is Alpha-bromo-3'-acetoxyacetophenone (CAS: 38396-89-3) typically synthesized?

Alpha-bromo-3'-acetoxyacetophenone is commonly synthesized through the bromination of 3'-acetoxyacetophenone using bromine in the presence of a base like potassium carbonate. The reaction is typically carried out under anhydrous conditions to ensure high yield and selectivity. This synthesis method provides a yield of around 70-80% and is a well-established procedure in organic chemistry.

What industries use Alpha-bromo-3'-acetoxyacetophenone (CAS: 38396-89-3)?

Alpha-bromo-3'-acetoxyacetophenone is primarily used in the pharmaceutical and polymer industries. Its unique chemical properties make it valuable in developing new drugs and as a monomer for synthesizing advanced polymers. It is also employed in the production of sensors and in semiconductor manufacturing for specific applications requiring high purity chemicals.

What precautions should be taken when handling Alpha-bromo-3'-acetoxyacetophenone (CAS: 38396-89-3)?

When handling Alpha-bromo-3'-acetoxyacetophenone, it is crucial to use proper personal protective equipment (PPE) including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or fume hood to minimize exposure. In case of a spill, use appropriate spill cleanup procedures and ensure the area is properly ventilated. Always consult the Safety Data Sheet (SDS) for detailed safety information and emergency procedures.