1-Bromo-1,1-dichloroacetone

Basic Information

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CAS Number

1751-16-2

Molecular Formula

C3H3BrCl2O

Molecular Weight

205.87 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

SMILES

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CC(=O)C(Br)(Cl)Cl

InChI

InChI=1S/C3H3BrCl2O/c1-2(7)3(4,5)6/h1H3

InChIKey

AZXDRUXVONQDAS-UHFFFAOYSA-N

LogP

2.1017

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Synonyms & References

English

1-Bromo-1,1-dichloro-2-propanone
1-bromo-1,1-dichloropropan-2-one

MDL Number

MFCD22055035

FAQ

What are the physical and chemical properties of 1-Bromo-1,1-dichloroacetone (CAS: 1751-16-2)?

1-Bromo-1,1-dichloroacetone (CAS: 1751-16-2) is a colorless to yellow liquid with a molecular weight of approximately 197.01 g/mol. It has a low solubility in water but good solubility in organic solvents. This compound is known for its reactivity, particularly in nucleophilic substitution reactions.

How is 1-Bromo-1,1-dichloroacetone (CAS: 1751-16-2) typically synthesized?

1-Bromo-1,1-dichloroacetone (CAS: 1751-16-2) can be synthesized through the reaction of acetone with bromine and chlorine in the presence of a Lewis acid catalyst, such as aluminum chloride. The reaction is typically carried out in a solvent like benzene, providing a yield of around 70-75%.

What industries use 1-Bromo-1,1-dichloroacetone (CAS: 1751-16-2)?

1-Bromo-1,1-dichloroacetone (CAS: 1751-16-2) finds applications in various industries, including pharmaceuticals, where it is used as a precursor in organic synthesis, and in the production of certain polymers and sensors. Its reactivity makes it valuable in these sectors.

What precautions should be taken when handling 1-Bromo-1,1-dichloroacetone (CAS: 1751-16-2)?

When handling 1-Bromo-1,1-dichloroacetone (CAS: 1751-16-2), it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure. Spills should be cleaned up using appropriate procedures, and the material safety data sheet (MSDS) or safety data sheet (SDS) should be consulted for detailed handling instructions.