1-Phenyl-1,2-propanedione

Basic Information

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CAS Number

579-07-7

Molecular Formula

C9H8O2

Molecular Weight

148.16 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Boiling Point

217°C

Refractive Index

n20/D 1.532(lit.)

SMILES

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CC(=O)C(=O)c1ccccc1

InChI

InChI=1S/C9H8O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6H,1H3

InChIKey

BVQVLAIMHVDZEL-UHFFFAOYSA-N

LogP

1.4583000000000002

Topological Polar Surface Area

34.14 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

166

Safety Information

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GHS Hazard Pictograms

H225

Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids

Hazard Class

Class Comb liq Class Comb liq

Synonyms & References

English

1-Phenylpropane-1,2-dione
1-Phenyl-1,2-propanedione
Acetyl benzoyl
Pyruvophenone
Acetylbenzoyl
Benzoylacetyl
1,2-Propanedione, 1-phenyl-
Methylphenylglyoxal
Phenylmethyldiketone
Benzoyl methyl ketone
Methyl phenyl diketone
3-Phenyl-2,3-propanedione
Methyl phenyl glyoxal
Phenyl methyl diketone
1-phenyl-1,2-propandione
1-Phenyl-propane-1,2-dione
FEMA No. 3226
ZB5XA3GD0I
BVQVLAIMHVDZEL-UHFFFAOYSA-N
1-Ph

MDL Number

MFCD00008755

Customs Code

2914399090

FAQ

What is 1-Phenyl-1,2-propanedione (CAS: 579-07-7)?

1-Phenyl-1,2-propanedione, with the CAS number 579-07-7, is an organic compound characterized by its ketone functional groups. It has the chemical formula C10H8O2 and is known for its aromatic structure and ability to undergo various chemical reactions. This compound is often used as an intermediate in synthetic chemistry due to its reactivity and versatility.

What are the main uses of 1-Phenyl-1,2-propanedione (CAS: 579-07-7)?

1-Phenyl-1,2-propanedione is primarily used in pharmaceutical research as a building block for drug synthesis. It also finds applications in the production of dyes, pigments, and other organic compounds. In the food industry, it may be used as a flavor enhancer, though its use is limited due to regulatory considerations. Its reactivity makes it valuable in chemical research and development.

Is 1-Phenyl-1,2-propanedione (CAS: 579-07-7) safe?

1-Phenyl-1,2-propanedione is generally considered safe when handled properly, but it can be toxic if ingested or inhaled in large quantities. It is important to follow safety protocols such as using personal protective equipment (PPE) and ensuring proper ventilation. Safety standards recommend adherence to OSHA and EPA guidelines to minimize exposure risks.

How should 1-Phenyl-1,2-propanedione (CAS: 579-07-7) be stored?

1-Phenyl-1,2-propanedione should be stored in a cool, dry, and well-ventilated area, away from light and moisture. It is best kept in a sealed container made of glass or inert material to prevent degradation. Storage conditions should maintain a temperature below 25°C and humidity levels below 60% to ensure stability and prolong shelf life.